SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing BPHYT_RS02230 FitnessBrowser__BFirm:BPHYT_RS02230 to proteins with known functional sites using BLASTp with E ≤ 0.001.

Or try Sites on a Tree, PaperBLAST, Conserved Domains, or compare to all protein structures

Found 20 (the maximum) hits to proteins with known functional sites (download)

8gqnA X-ray structure of thiolase with coa
63% identity, 98% coverage: 9:397/397 of query aligns to 3:390/390 of 8gqnA

query
sites
8gqnA

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binding coenzyme a: L147 (= L153), Q217 (= Q224), I226 (= I233), L229 (= L236), A241 (= A248), A242 (= A249), S245 (= S252), I247 (= I254)

6aqpA Aspergillus fumigatus cytosolic thiolase: acetylated enzyme in complex with coa and potassium ions
50% identity, 98% coverage: 9:397/397 of query aligns to 8:397/397 of 6aqpA

query
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6aqpA

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active site: C93 (= C93), H353 (= H353), C383 (= C383), G385 (= G385)
binding coenzyme a: C93 (= C93), L153 (= L153), Y188 (≠ L189), N226 (≠ K227), N228 (= N229), K231 (= K232), A248 (= A248), P249 (≠ A249), S252 (= S252), A323 (= A323), F324 (= F324), H353 (= H353)

Q4WCL5 Acetyl-CoA acetyltransferase erg10B, cytosolic; Acetoacetyl-CoA thiolase erg10B; ACAT; Cytosolic thiolase erg10B; CT; Ergosterol biosynthesis protein 10B; EC 2.3.1.9 from Aspergillus fumigatus (strain ATCC MYA-4609 / CBS 101355 / FGSC A1100 / Af293) (Neosartorya fumigata)
50% identity, 98% coverage: 9:397/397 of query aligns to 7:398/398 of Q4WCL5

query
sites
Q4WCL5

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Y187 (≠ L189) binding K(+)
N229 (= N229) binding CoA
K232 (= K232) binding CoA
A249 (= A248) binding K(+)
P250 (≠ A249) binding K(+)
S252 (= S251) binding K(+)
S253 (= S252) binding CoA
V350 (≠ C349) binding K(+)
N385 (≠ I384) binding chloride

6aqpC Aspergillus fumigatus cytosolic thiolase: acetylated enzyme in complex with coa and potassium ions
50% identity, 98% coverage: 9:397/397 of query aligns to 8:399/399 of 6aqpC

query
sites
6aqpC

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V

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M

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N

N

A

A

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P

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L

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M

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D

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F

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L

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P

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N

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G

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|
H

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P

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I

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A

A

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R

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A

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K

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K

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K

R

L

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|
C

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G

G

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G

V

I

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E

E

L

L

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L

active site: C93 (= C93), H355 (= H353), C385 (= C383), G387 (= G385)
binding acetyl coenzyme *a: C93 (= C93), L153 (= L153), M162 (= M163), Y188 (≠ L189), N230 (= N229), K233 (= K232), L234 (≠ I233), I237 (≠ L236), A250 (= A248), P251 (≠ A249), S254 (= S252), F295 (= F293), A325 (= A323), F326 (= F324), H355 (= H353)

P45359 Acetyl-CoA acetyltransferase; Acetoacetyl-CoA thiolase; CaTHL; EC 2.3.1.9 from Clostridium acetobutylicum (strain ATCC 824 / DSM 792 / JCM 1419 / IAM 19013 / LMG 5710 / NBRC 13948 / NRRL B-527 / VKM B-1787 / 2291 / W) (see paper)
49% identity, 97% coverage: 9:395/397 of query aligns to 4:390/392 of P45359

query
sites
P45359

I

V

V

V

I

I

V

A

G

S

V

A

A

V

R

R

T

T

P

A

M

I

A

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A

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F

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A

K

A

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L

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A

A

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L

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G

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A

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T

A

A

I

I

E

K

A

E

A

A

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V

K

K

R

K

A

A

G

G

L

I

K

K

P

P

E

E

Q

D

V

V

D

N

E

E

V

V

V

I

M

L

G

G

C

N

V

V

L

L

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Q

A

A

G

G

L

L

G

G

Q

Q

A

N

P

P

A

A

R

R

Q

Q

A

A

A

S

L

F

G

K

A

A

G

G

L

L

P

P

L
x
V

A

E

T

I

G

P

S

A

T

M

T

T

V

I

N

N

K

K

M

V

C
|
C

G

G

S

S

G

G

M

L

R

R

A

T

A

V

M
x
S

F

L

A

A

H

A

D

Q

M

I

L

I

A

K

A

A

G

G

S

D

V

A

D

D

V

V

I

I

V

I

A

A

G

G

G

G

M

M

E

E

S

N

M

M

T

S

N

R

A

A

P

P

Y

Y

L

L

L

A

P

N

K

N

A

A

R

R

N

W

G

G

M

Y

R

R

M

M

G

G

H

N

G

A

Q

K

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F

I

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D

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M

F

I

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T

D

D

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G

L

L

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W

D

D

A

A

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F

E
x
N

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D

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Y

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H

L

-

M

M

G

G

T

I

F

T

A

A

E

E

E

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C

I

A

A

A

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D

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F

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E

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Q

D

D

A

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F

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A

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A

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A

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D

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D

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R

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K

K

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D

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G

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A

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A

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x
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|
A

K

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A

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A

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A

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A

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R

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A

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D

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I

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A

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A

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A

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P

D

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N

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G

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G

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A

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I

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E

V77 (≠ L82) mutation to Q: 3-fold increase in thiolase activity, prevents disulfide bond formation under oxidized condition and results in the loss of regulatory mechanism based on redox-switch modulation; when associated with Y-153 and K-286.
C88 (= C93) modified: Disulfide link with 378, In inhibited form
S96 (≠ M101) binding acetate
N153 (≠ E158) mutation to Y: 3-fold increase in thiolase activity, prevents disulfide bond formation under oxidized condition and results in the loss of regulatory mechanism based on redox-switch modulation; when associated with Q-77 and K-286.
GS 279:280 (≠ ST 284:285) binding acetate
A286 (= A291) mutation to K: 3-fold increase in thiolase activity, prevents disulfide bond formation under oxidized condition and results in the loss of regulatory mechanism based on redox-switch modulation; when associated with Q-77 and Y-153.
C378 (= C383) modified: Disulfide link with 88, In inhibited form
A386 (= A391) binding acetate

4xl4A Crystal structure of thiolase from clostridium acetobutylicum in complex with coa (see paper)
49% identity, 97% coverage: 9:395/397 of query aligns to 4:390/392 of 4xl4A

query
sites
4xl4A

I

V

V

V

I

I

V

A

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A

A

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K

A

A

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N

E

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G

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V

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A

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G

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L

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G

Q

Q

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P

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A

A

A

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K

A

A

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G

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L

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P

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E

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P

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A

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M

T

T

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C

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S

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R

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A

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D

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V

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I

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A

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M

M

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S

N

R

A

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P

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Y

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A

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W

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A

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R
x
H

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M

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T

A

A

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E

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A

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A

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D

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E

A

E

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Q

D

D

A

E

F

F

A

A

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E

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A

A

K

E

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E

A

A

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I

E

K

D

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G

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S

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F

F

G

K

W

D

E

E

I

I

A

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P

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V

K

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V

I

E

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R

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K

G

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D

E

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T

T

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I

V

D

D

R

T

D

D

E

E

Q

H

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P

-
x
R

F

F

K

G

A

S

N

T

P

I

E

E

K

G

I

L

P

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T

K

L
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L

K

K

P

P

A

A

F

F

S

K

K

K

T

D

G

G

T

T

V

V

T

T

A
|
A

A

G

N

N

S

A

S
|
S

S

G

I

L

S

N

D

D

G

C

A

A

A

A

A

V

L

L

V

V

M

I

M

M

R

S

E

A

S

E

T

K

A

A

R

K

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E

L

L

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G

V

V

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K

P

P

I

L

A

A

R

K

V

I

V

V

G

S

H

Y

S

G

T

S

F

A

A

G

Q

V

E

D

P

P

A

A

K

I

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M

T

G

T

Y

A

G

P

P

V

F

G

Y

A

A

I

T

R

K

K

A

L

A

F

I

E

E

K

K

N

A

G

G

W

W

R

T

A

V

D

D

E

E

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L

D

D

L

L

Y

I

E

E

V

S

N

N

E

E

A

A

F
|
F

A

A

V

A

V

Q

T

S

M

L

A

A

A

V

M

A

K

K

E

D

H

L

H

K

L

F

P

D

H

M

E

N

K

K

V

V

N

N

V

V

N

N

G

G

G

G

A

A

C

I

A

A

L

L

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H
|
H

P

P

I

I

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G

A

A

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S

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G

A

A

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R

I

I

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L

V

V

T

T

L

L

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V

G

H

A

A

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K

K

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D

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A

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K

R

K

G

G

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L

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A

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T

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x
S

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|
G

G

G

G

G

E

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A

G

T

T

A

A

M

I

G

L

I

L

E

E

active site: C88 (= C93), H348 (= H353), S378 (≠ C383), G380 (= G385)
binding coenzyme a: L148 (= L153), H156 (≠ R161), R220 (vs. gap), L231 (= L236), A243 (= A248), S247 (= S252), F319 (= F324), H348 (= H353)

6bn2A Crystal structure of acetyl-coa acetyltransferase from elizabethkingia anophelis nuhp1
47% identity, 97% coverage: 9:395/397 of query aligns to 4:390/393 of 6bn2A

query
sites
6bn2A

I

V

V

F

I

I

V

V

G

S

V

A

A

V

R

R

T

T

P

P

M

M

A

G

A

S

F

F

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M

G

G

D

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F

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A

S

A

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L

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A

A

P

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Q

Q

L

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G

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A

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V

A

A

I

I

E

K

A

G

A

A

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K

D

R

K

A

I

G

N

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L

K

N

P

P

E

A

Q

E

V

I

D

Q

E

D

V

V

V

Y

M

M

G

G

C

N

V

V

L

L

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Q

A

A

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G

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E

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G

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Q

A

A

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P

A

A

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Q

Q

A

A

A

A

L

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G

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A

A

G

G

L

L

P

P

L

N

A

T

T

T

G

P

S

T

T

T

T

A

V

V

N

N

K

K

M

V

C
|
C

G

A

S

S

G

G

M

M

R

K

A

A

A

V

M

M

F

M

A

A

H

A

D

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M

A

L

V

A

K

A

A

G

G

S

D

V

V

D

E

V

A

I

I

V

V

A

A

G

G

G

G

M

M

E

E

S

N

M

M

T

S

N

Q

A

V

P

P

Y

H

L

Y

L

I

P

-

K

D

A

G

R

R

N

N

G

G

M

V

R

K

M

L

G

G

H

D

G

I

Q

K

V

L

I

Q

D

D

H

G

M

L

F

L

Y

K

D

D

G

G

L

L

E

T

D

D

A

V

Y

Y

E

S

K

K

G

-

R

Q

L

H

M

M

G

G

T

N

F

C

A

A

E

E

E

L

C

C

A

A

A

K

S

E

F

Y

D

N

F

I

T

T

R

R

E

E

A

E

Q

Q

D

D

A

A

F

F

A

A

V

I

E

Q

S

S

L
x
Y

N

E

R

R

A

S

K

A

R

K

A

A

N

W

E

S

D

E

G

G

S

K

F

F

G

K

W

E

E

E

I

V

A

V

P

P

V

V

K

S

V

I

E

P

S

Q

R

R

K

K

G

G

D

E

V

P

T

I

I

I

D

F

R

A

D

E

E

D

Q

E

P

E

F

Y

K

K

-

N

A

V

N

K

P

F

E

D

K

R

I

I

P

P

T

T

L

L

K

P

P

T

A

V

F

F

S

Q

K

K

-

E

T

N

G

G

T

T

V

V

T

T

A
|
A

A
|
A

N

N

S
x
A

S

S

S

T

I

L

S

N

D

D

G

G

A

A

A

S

A

A

L

L

V

V

M

L

M

M

R

S

E

K

S

E

T

K

A

M

R

E

R

S

L

L

G

G

V

L

E

K

P

P

I

L

A

A

R

K

V

I

V

V

G

S

H

Y

S

A

T

D

F

A

A

A

Q

Q

E

A

P

P

A

E

K

W

F

F

T

T

T

T

A

A

P

P

V

A

G

K

A

A

I

L

R

P

K

I

L

A

F

L

E

A

K

K

N

A

G

N

W

L

R

T

A

I

D

N

E

D

V

I

D

D

L

F

Y

F

E

E

V

F

N

N

E

E

A

A

F

F

A

S

V

V

V

V

T

G

M

L

A

A

A

N

M

N

K

K

E

I

H

L

H

G

L

L

P

D

H

A

E

A

K

K

V

V

N

N

V

V

N

N

G

G

G

G

A

A

C
x
V

A

A

L

L

G

G

H
|
H

P

P

I

L

G

G

A

S

S

S

G

G

A

S

R

R

I

I

L

I

V

V

T

T

L

L

I

I

G

N

A

V

L

L

K

K

K

Q

R

N

G

N

L

A

K

K

R

Y

G

G

V

A

A

A

T

A

L

I

C
|
C

I

N

G
|
G

G

G

G

G

E

G

A

A

T

S

A

A

M

I

G

V

I

I

E

E

active site: C88 (= C93), H348 (= H353), C378 (= C383), G380 (= G385)
binding calcium ion: Y182 (≠ L189), A243 (= A248), A244 (= A249), A246 (≠ S251), V344 (≠ C349)

2vu2A Biosynthetic thiolase from z. Ramigera. Complex with s-pantetheine-11- pivalate. (see paper)
48% identity, 97% coverage: 9:395/397 of query aligns to 2:387/389 of 2vu2A

query
sites
2vu2A

I

I

V

V

I

I

V

A

G

S

V

A

A

A

R

R

T

T

P

A

M

V

A

G

A

S

F

F

Q

N

G

G

D

A

F

F

A

A

A

N

L

T

T

P

A

A

P

H

Q

E

L

L

G

G

S

A

V

T

A

V

I

I

E

S

A

A

A

V

V

L

K

E

R

R

A

A

G

G

L

V

K

A

P

A

E

G

Q

E

V

V

D

N

E

E

V

V

V

I

M

L

G

G

C

Q

V

V

L

L

P

P

A

A

G

G

L

E

G

G

Q

Q

A

N

P

P

A

A

R

R

Q

Q

A

A

A

A

L

M

G

K

A

A

G

G

L

V

P

P

L

Q

A

E

T

A

G

T

S

A

T

W

T

G

V

M

N

N

K

Q

M

L

C
|
C

G

G

S

S

G

G

M

L

R

R

A

A

A

V

M

A

F

L

A

G

H

M

D

Q

M

Q

L

I

A

A

A

T

G

G

S

D

V

A

D

S

V

I

I

I

V

V

A

A

G

G

G

G

M

M

E

E

S

S

M

M

T

S

N

M

A

A

P

P

Y

H

L

C

L

-

P

A

K

H

A

L

R

R

N

G

G

G

M

V

R

K

M

M

G

G

H

D

G

F

Q

K

V

M

I

I

D

D

H

T

M

M

F

I

Y

K

D

D

G

G

L

L

E

T

D

D

A

A

Y

F

E

-

K

Y

G

G

R

Y

L
x
H

M
|
M

G

G

T

T

F

T

A

A

E

E

E

N

C

V

A

A

A

K

S

Q

F

W

D

Q

F

L

T

S

R

R

E

D

A

E

Q

Q

D

D

A

A

F

F

A

A

V

V

E

A

S

S

L

Q

N

N

R

K

A

A

K

E

R

A

A

A

N

Q

E

K

D

D

G

G

S

R

F

F

G

K

W

D

E

E

I

I

A

V

P

P

V

F

K

I

V

V

E

K

S

G

R

R

K

K

G

G

D

D

V

I

T

T

I

V

D

D

R

A

D

D

E

E

Q

Y

-

I

P

R

F

H

K

G

A

A

N

T

P

L

E

D

K

S

I

M

P

A

T

K

L

L

K

R

P

P

A

A

F
|
F

S

D

K

K

T

E

G

G

T

T

V

V

T

T

A

A

A

G

N

N

S

A

S
|
S

S
x
G

I

L

S

N

D

D

G

G

A

A

A

A

A

A

L

A

V

L

M

L

M

M

R

S

E

E

S

A

T

E

A

A

R

S

R

R

L

R

G

G

V

I

E

Q

P

P

I

L

A

G

R

R

V

I

V

V

G

S

H

W

S

A

T

T

F

V

A

G

Q

V

E

D

P

P

A

K

K

V

F

M

T

G

T

T

A

G

P

P

V

I

G

P

A

A

I

S

R

R

K

K

L

A

F

L

E

E

K

R

N

A

G

G

W

W

R

K

A

I

D

G

E

D

V

L

D

D

L

L

Y

V

E

E

V

A

N

N

E

E

A

A

F
|
F

A

A

V

A

V

Q

T

A

M

C

A

A

A

V

M

N

K

K

E

D

H

L

H

G

L

W

P

D

H

P

E

S

K

I

V

V

N

N

V

V

N

N

G

G

G

G

A

A

C

I

A

A

L

I

G

G

H
|
H

P

P

I

I

G

G

A

A

S

S

G

G

A

A

R

R

I

I

L

L

V

N

T

T

L

L

I

L

G

F

A

E

L

M

K

K

K

R

R

R

G

G

L

A

K

R

R

K

G

G

V

L

A

A

T

T

L

L

C
|
C

I

I

G
|
G

G

G

G

G

E

M

A

G

T

V

A

A

M

M

G

C

I

I

E

E

active site: C86 (= C93), H345 (= H353), C375 (= C383), G377 (= G385)
binding (3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl 2,2-dimethylpropanoate: H153 (≠ L162), M154 (= M163), F232 (= F240), S244 (= S252), G245 (≠ S253), F316 (= F324), H345 (= H353)

1dm3A Acetylated biosynthetic thiolase from zoogloea ramigera in complex with acetyl-coa (see paper)
48% identity, 97% coverage: 9:395/397 of query aligns to 2:387/389 of 1dm3A

query
sites
1dm3A

I

I

V

V

I

I

V

A

G

S

V

A

A

A

R

R

T

T

P

A

M

V

A

G

A

S

F

F

Q

N

G

G

D

A

F

F

A

A

A

N

L

T

T

P

A

A

P

H

Q

E

L

L

G

G

S

A

V

T

A

V

I

I

E

S

A

A

A

V

V

L

K

E

R

R

A

A

G

G

L

V

K

A

P

A

E

G

Q

E

V

V

D

N

E

E

V

V

V

I

M

L

G

G

C

Q

V

V

L

L

P

P

A

A

G

G

L

E

G

G

Q

Q

A

N

P

P

A

A

R

R

Q

Q

A

A

A

A

L

M

G

K

A

A

G

G

L

V

P

P

L

Q

A

E

T

A

G

T

S

A

T

W

T

G

V

M

N

N

K

Q

M

L

C
|
C

G

G

S

S

G

G

M

L

R

R

A

A

A

V

M

A

F

L

A

G

H

M

D

Q

M

Q

L

I

A

A

A

T

G

G

S

D

V

A

D

S

V

I

I

I

V

V

A

A

G

G

G

G

M

M

E

E

S

S

M

M

T

S

N

M

A

A

P

P

Y

H

L

C

L

-

P

A

K

H

A

L

R

R

N

G

G

G

M

V

R

K

M

M

G

G

H

D

G

F

Q

K

V

M

I

I

D

D

H

T

M

M

F

I

Y

K

D

D

G

G

L
|
L

E

T

D

D

A

A

Y

F

E

-

K

Y

G

G

R

Y

L
x
H

M
|
M

G

G

T

T

F

T

A

A

E

E

E

N

C

V

A

A

A

K

S

Q

F

W

D

Q

F

L

T

S

R

R

E

D

A

E

Q

Q

D

D

A

A

F

F

A

A

V

V

E

A

S

S

L

Q

N

N

R

K

A

A

K

E

R

A

A

A

N

Q

E

K

D

D

G

G

S

R

F

F

G

K

W

D

E

E

I

I

A

V

P

P

V

F

K

I

V

V

E

K

S

G

R

R

K

K

G

G

D

D

V

I

T

T

I

V

D

D

R

A

D

D

E

E

Q

Y

-

I

P
x
R

F

H

K

G

A

A

N

T

P

L

E

D

K
x
S

I
x
M

P

A

T

K

L

L

K

R

P

P

A

A

F

F

S

D

K

K

T

E

G

G

T

T

V

V

T

T

A
|
A

A

G

N

N

S

A

S
|
S

S

G

I

L

S

N

D

D

G

G

A

A

A

A

A

A

L

A

V

L

M

L

M

M

R

S

E

E

S

A

T

E

A

A

R

S

R

R

L

R

G

G

V

I

E

Q

P

P

I

L

A

G

R

R

V

I

V

V

G

S

H

W

S

A

T

T

F

V

A

G

Q

V

E

D

P

P

A

K

K

V

F
x
M

T

G

T

T

A

G

P

P

V

I

G

P

A

A

I

S

R

R

K

K

L

A

F

L

E

E

K

R

N

A

G

G

W

W

R

K

A

I

D

G

E

D

V

L

D

D

L

L

Y

V

E

E

V

A

N

N

E

E

A
|
A

F
|
F

A

A

V

A

V

Q

T

A

M

C

A

A

A

V

M

N

K

K

E

D

H

L

H

G

L

W

P

D

H

P

E

S

K

I

V

V

N

N

V

V

N

N

G

G

G

G

A

A

C

I

A

A

L

I

G

G

H
|
H

P

P

I

I

G

G

A

A

S

S

G

G

A

A

R

R

I

I

L

L

V

N

T

T

L

L

I

L

G

F

A

E

L

M

K

K

K

R

R

R

G

G

L

A

K

R

R

K

G

G

V

L

A

A

T

T

L

L

C
|
C

I

I

G
|
G

G

G

G

G

E

M

A

G

T

V

A

A

M

M

G

C

I

I

E

E

active site: C86 (= C93), H345 (= H353), C375 (= C383), G377 (= G385)
binding acetyl coenzyme *a: C86 (= C93), L145 (= L153), H153 (≠ L162), M154 (= M163), R217 (≠ P225), S224 (≠ K232), M225 (≠ I233), A240 (= A248), S244 (= S252), M285 (≠ F293), A315 (= A323), F316 (= F324), H345 (= H353), C375 (= C383)

1dlvA Biosynthetic thiolase from zoogloea ramigera in complex with coa (see paper)
48% identity, 97% coverage: 9:395/397 of query aligns to 2:387/389 of 1dlvA

query
sites
1dlvA

I

I

V

V

I

I

V

A

G

S

V

A

A

A

R

R

T

T

P

A

M

V

A

G

A

S

F

F

Q

N

G

G

D

A

F

F

A

A

A

N

L

T

T

P

A

A

P

H

Q

E

L

L

G

G

S

A

V

T

A

V

I

I

E

S

A

A

A

V

V

L

K

E

R

R

A

A

G

G

L

V

K

A

P

A

E

G

Q

E

V

V

D

N

E

E

V

V

V

I

M

L

G

G

C

Q

V

V

L

L

P

P

A

A

G

G

L

E

G

G

Q

Q

A

N

P

P

A

A

R

R

Q

Q

A

A

A

A

L

M

G

K

A

A

G

G

L

V

P

P

L

Q

A

E

T

A

G

T

S

A

T

W

T

G

V

M

N

N

K

Q

M

L

C
|
C

G

G

S

S

G

G

M

L

R

R

A

A

A

V

M

A

F

L

A

G

H

M

D

Q

M

Q

L

I

A

A

A

T

G

G

S

D

V

A

D

S

V

I

I

I

V

V

A

A

G

G

G

G

M

M

E

E

S

S

M

M

T

S

N

M

A

A

P

P

Y

H

L

C

L

-

P

A

K

H

A

L

R

R

N

G

G

G

M

V

R

K

M

M

G

G

H

D

G

F

Q

K

V

M

I

I

D

D

H

T

M

M

F

I

Y

K

D

D

G

G

L
|
L

E

T

D

D

A

A

Y

F

E

-

K

Y

G

G

R

Y

L
x
H

M
|
M

G

G

T

T

F

T

A

A

E

E

E

N

C

V

A

A

A

K

S

Q

F

W

D

Q

F

L

T

S

R

R

E

D

A

E

Q

Q

D

D

A

A

F

F

A

A

V

V

E

A

S

S

L

Q

N

N

R

K

A

A

K

E

R

A

A

A

N

Q

E

K

D

D

G

G

S

R

F

F

G

K

W

D

E

E

I

I

A

V

P

P

V

F

K

I

V

V

E

K

S

G

R

R

K

K

G

G

D

D

V

I

T

T

I

V

D

D

R

A

D

D

E

E

Q

Y

-

I

P
x
R

F

H

K

G

A

A

N

T

P

L

E

D

K

S

I

M

P

A

T

K

L
|
L

K

R

P

P

A

A

F

F

S

D

K

K

T

E

G

G

T

T

V

V

T

T

A
|
A

A

G

N

N

S

A

S
|
S

S

G

I

L

S

N

D

D

G

G

A

A

A

A

A

A

L

A

V

L

M

L

M

M

R

S

E

E

S

A

T

E

A

A

R

S

R

R

L

R

G

G

V

I

E

Q

P

P

I

L

A

G

R

R

V

I

V

V

G

S

H

W

S

A

T

T

F

V

A

G

Q

V

E

D

P

P

A

K

K

V

F

M

T

G

T

T

A

G

P

P

V

I

G

P

A

A

I

S

R

R

K

K

L

A

F

L

E

E

K

R

N

A

G

G

W

W

R

K

A

I

D

G

E

D

V

L

D

D

L

L

Y

V

E

E

V

A

N

N

E

E

A

A

F

F

A

A

V

A

V

Q

T

A

M

C

A

A

A

V

M

N

K

K

E

D

H

L

H

G

L

W

P

D

H

P

E

S

K

I

V

V

N

N

V

V

N

N

G

G

G

G

A

A

C

I

A

A

L

I

G

G

H
|
H

P

P

I

I

G

G

A

A

S

S

G

G

A

A

R

R

I

I

L

L

V

N

T

T

L

L

I

L

G

F

A

E

L

M

K

K

K

R

R

R

G

G

L

A

K

R

R

K

G

G

V

L

A

A

T

T

L

L

C
|
C

I

I

G
|
G

G

G

G

G

E

M

A

G

T

V

A

A

M

M

G

C

I

I

E

E

active site: C86 (= C93), H345 (= H353), C375 (= C383), G377 (= G385)
binding coenzyme a: C86 (= C93), L145 (= L153), H153 (≠ L162), M154 (= M163), R217 (≠ P225), L228 (= L236), A240 (= A248), S244 (= S252), H345 (= H353)

2vu1A Biosynthetic thiolase from z. Ramigera. Complex of with o-pantheteine- 11-pivalate. (see paper)
48% identity, 97% coverage: 9:395/397 of query aligns to 4:389/391 of 2vu1A

query
sites
2vu1A

I

I

V

V

I

I

V

A

G

S

V

A

A

A

R

R

T

T

P

A

M

V

A

G

A

S

F

F

Q

N

G

G

D

A

F

F

A

A

A

N

L

T

T

P

A

A

P

H

Q

E

L

L

G

G

S

A

V

T

A

V

I

I

E

S

A

A

A

V

V

L

K

E

R

R

A

A

G

G

L

V

K

A

P

A

E

G

Q

E

V

V

D

N

E

E

V

V

V

I

M

L

G

G

C

Q

V

V

L

L

P

P

A

A

G

G

L

E

G

G

Q

Q

A

N

P

P

A

A

R

R

Q

Q

A

A

A

A

L

M

G

K

A

A

G

G

L

V

P

P

L

Q

A

E

T

A

G

T

S

A

T

W

T

G

V

M

N

N

K

Q

M

L

C
|
C

G

G

S

S

G

G

M

L

R

R

A

A

A

V

M

A

F

L

A

G

H

M

D

Q

M

Q

L

I

A

A

A

T

G

G

S

D

V

A

D

S

V

I

I

I

V

V

A

A

G

G

G

G

M

M

E

E

S

S

M

M

T

S

N

M

A

A

P

P

Y

H

L

C

L

-

P

A

K

H

A

L

R

R

N

G

G

G

M

V

R

K

M

M

G

G

H

D

G

F

Q

K

V

M

I

I

D

D

H

T

M

M

F

I

Y

K

D

D

G

G

L

L

E

T

D

D

A

A

Y

F

E

-

K

Y

G

G

R

Y

L
x
H

M

M

G

G

T

T

F

T

A

A

E

E

E

N

C

V

A

A

A

K

S

Q

F

W

D

Q

F

L

T

S

R

R

E

D

A

E

Q

Q

D

D

A

A

F

F

A

A

V

V

E

A

S

S

L

Q

N

N

R

K

A

A

K

E

R

A

A

A

N

Q

E

K

D

D

G

G

S

R

F

F

G

K

W

D

E

E

I

I

A

V

P

P

V

F

K

I

V

V

E

K

S

G

R

R

K

K

G

G

D

D

V

I

T

T

I

V

D

D

R

A

D

D

E

E

Q

Y

-

I

P

R

F

H

K

G

A

A

N

T

P

L

E

D

K

S

I

M

P

A

T

K

L

L

K

R

P

P

A

A

F
|
F

S

D

K

K

T

E

G

G

T

T

V

V

T

T

A

A

A

G

N

N

S

A

S
|
S

S

G

I

L

S

N

D

D

G

G

A

A

A

A

A

A

L

A

V

L

M

L

M

M

R

S

E

E

S

A

T

E

A

A

R

S

R

R

L

R

G

G

V

I

E

Q

P

P

I

L

A

G

R

R

V

I

V

V

G

S

H

W

S

A

T

T

F

V

A

G

Q

V

E

D

P

P

A

K

K

V

F

M

T

G

T

T

A

G

P

P

V

I

G

P

A

A

I

S

R

R

K

K

L

A

F

L

E

E

K

R

N

A

G

G

W

W

R

K

A

I

D

G

E

D

V

L

D

D

L

L

Y

V

E

E

V

A

N

N

E

E

A
|
A

F
|
F

A

A

V

A

V

Q

T

A

M

C

A

A

A

V

M

N

K

K

E

D

H

L

H

G

L

W

P

D

H

P

E

S

K

I

V

V

N

N

V

V

N

N

G

G

G

G

A

A

C

I

A

A

L

I

G

G

H
|
H

P

P

I

I

G

G

A

A

S

S

G

G

A

A

R

R

I

I

L

L

V

N

T

T

L

L

I

L

G

F

A

E

L

M

K

K

K

R

R

R

G

G

L

A

K

R

R

K

G

G

V

L

A

A

T

T

L

L

C
|
C

I

I

G
|
G

G

G

G

G

E

M

A

G

T

V

A

A

M

M

G

C

I

I

E

E

active site: C88 (= C93), H347 (= H353), C377 (= C383), G379 (= G385)
binding pantothenyl-aminoethanol-11-pivalic acid: H155 (≠ L162), F234 (= F240), S246 (= S252), A317 (= A323), F318 (= F324), H347 (= H353)

1ou6A Biosynthetic thiolase from zoogloea ramigera in complex with acetyl-o- pantetheine-11-pivalate
48% identity, 97% coverage: 9:395/397 of query aligns to 5:390/392 of 1ou6A

query
sites
1ou6A

I

I

V

V

I

I

V

A

G

S

V

A

A

A

R

R

T

T

P

A

M

V

A

G

A

S

F

F

Q

N

G

G

D

A

F

F

A

A

A

N

L

T

T

P

A

A

P

H

Q

E

L

L

G

G

S

A

V

T

A

V

I

I

E

S

A

A

A

V

V

L

K

E

R

R

A

A

G

G

L

V

K

A

P

A

E

G

Q

E

V

V

D

N

E

E

V

V

V

I

M

L

G

G

C

Q

V

V

L

L

P

P

A

A

G

G

L

E

G

G

Q

Q

A

N

P

P

A

A

R

R

Q

Q

A

A

A

A

L

M

G

K

A

A

G

G

L

V

P

P

L

Q

A

E

T

A

G

T

S

A

T

W

T

G

V

M

N

N

K

Q

M

L

C
|
C

G

G

S

S

G

G

M

L

R

R

A

A

A

V

M

A

F

L

A

G

H

M

D

Q

M

Q

L

I

A

A

A

T

G

G

S

D

V

A

D

S

V

I

I

I

V

V

A

A

G

G

G

G

M

M

E

E

S

S

M

M

T

S

N

M

A

A

P

P

Y

H

L

C

L

-

P

A

K

H

A

L

R

R

N

G

G

G

M

V

R

K

M

M

G

G

H

D

G

F

Q

K

V

M

I

I

D

D

H

T

M

M

F

I

Y

K

D

D

G

G

L
|
L

E

T

D

D

A

A

Y

F

E

-

K

Y

G

G

R

Y

L
x
H

M
|
M

G

G

T

T

F

T

A

A

E

E

E

N

C

V

A

A

A

K

S

Q

F

W

D

Q

F

L

T

S

R

R

E

D

A

E

Q

Q

D

D

A

A

F

F

A

A

V

V

E

A

S

S

L

Q

N

N

R

K

A

A

K

E

R

A

A

A

N

Q

E

K

D

D

G

G

S

R

F

F

G

K

W

D

E

E

I

I

A

V

P

P

V

F

K

I

V

V

E

K

S

G

R

R

K

K

G

G

D

D

V

I

T

T

I

V

D

D

R

A

D

D

E

E

Q

Y

-

I

P

R

F

H

K

G

A

A

N

T

P

L

E

D

K

S

I

M

P

A

T

K

L

L

K

R

P

P

A

A

F
|
F