SitesBLAST
Comparing WP_078717693.1 NCBI__GCF_900167125.1:WP_078717693.1 to proteins with known functional sites using BLASTp with E ≤ 0.001.
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Found 17 hits to proteins with known functional sites (download)
6n2oD 2-oxoglutarate:ferredoxin oxidoreductase from magnetococcus marinus with 2-oxoglutarate, coenzyme a and succinyl-coa bound (see paper)
41% identity, 81% coverage: 13:227/267 of query aligns to 21:227/291 of 6n2oD
- binding magnesium ion: D101 (= D93), N129 (= N121), I131 (= I123)
- binding succinyl-coenzyme a: I57 (= I49), R62 (= R54), L134 (≠ M126), K136 (≠ G128)
- binding iron/sulfur cluster: W24 (= W16), C25 (= C17), C28 (= C20), C59 (= C51), C208 (= C200), T210 (= T202), F211 (≠ Y203)
- binding thiamine diphosphate: I57 (= I49), G58 (= G50), C59 (= C51), S60 (= S52), H76 (= H68), G102 (= G94), D103 (= D95), N129 (= N121), I131 (= I123), G133 (= G125), L134 (≠ M126), T135 (= T127)
6n2oB 2-oxoglutarate:ferredoxin oxidoreductase from magnetococcus marinus with 2-oxoglutarate, coenzyme a and succinyl-coa bound (see paper)
41% identity, 81% coverage: 13:227/267 of query aligns to 21:227/291 of 6n2oB
- binding 2-oxoglutaric acid: R62 (= R54), L134 (≠ M126)
- binding coenzyme a: K136 (≠ G128), Y150 (≠ T142)
- binding magnesium ion: D101 (= D93), N129 (= N121), I131 (= I123)
- binding iron/sulfur cluster: W24 (= W16), C25 (= C17), C28 (= C20), C59 (= C51), C208 (= C200), T210 (= T202), F211 (≠ Y203)
- binding thiamine diphosphate: I57 (= I49), G58 (= G50), C59 (= C51), S60 (= S52), H76 (= H68), G102 (= G94), D103 (= D95), N129 (= N121), I131 (= I123), Y132 (= Y124), G133 (= G125), L134 (≠ M126), T135 (= T127)
6n2nB Crystal structure of 2-oxoglutarate:ferredoxin oxidoreductase from magnetococcus marinus (see paper)
41% identity, 81% coverage: 13:227/267 of query aligns to 21:227/291 of 6n2nB
- binding magnesium ion: D101 (= D93), N129 (= N121), I131 (= I123)
- binding iron/sulfur cluster: W24 (= W16), C25 (= C17), C28 (= C20), H30 (= H22), C59 (= C51), C208 (= C200), T210 (= T202), F211 (≠ Y203)
- binding thiamine diphosphate: I57 (= I49), G58 (= G50), C59 (= C51), S60 (= S52), H76 (= H68), G100 (= G92), D101 (= D93), G102 (= G94), D103 (= D95), N129 (= N121), I131 (= I123), Y132 (= Y124), G133 (= G125), L134 (≠ M126), T135 (= T127)
5b46B 2-oxoacid:ferredoxin oxidoreductase 2 from sulfolobus tokodai - ligand free form (see paper)
44% identity, 70% coverage: 16:203/267 of query aligns to 8:197/301 of 5b46B
- binding magnesium ion: D87 (= D93), N115 (= N121), V117 (≠ I123)
- binding iron/sulfur cluster: W8 (= W16), C9 (= C17), C12 (= C20), C43 (= C51), C194 (= C200), T196 (= T202), Y197 (= Y203)
- binding thiamine diphosphate: I41 (= I49), G42 (= G50), C43 (= C51), S44 (= S52), H62 (= H68), G86 (= G92), G88 (= G94), D89 (= D95), N115 (= N121), V117 (≠ I123), Y118 (= Y124), G119 (= G125), L120 (≠ M126), T121 (= T127)
Q96XT4 2-oxoacid:ferredoxin oxidoreductase 2, subunit beta; OFOR2; EC 1.2.7.11 from Sulfurisphaera tokodaii (strain DSM 16993 / JCM 10545 / NBRC 100140 / 7) (Sulfolobus tokodaii) (see paper)
44% identity, 70% coverage: 16:203/267 of query aligns to 11:200/304 of Q96XT4
- C12 (= C17) binding [4Fe-4S] cluster
- C15 (= C20) binding [4Fe-4S] cluster
- IGCS 44:47 (= IGCS 49:52) binding thiamine diphosphate
- C46 (= C51) binding [4Fe-4S] cluster
- D90 (= D93) binding Mg(2+)
- GD 91:92 (= GD 94:95) binding thiamine diphosphate
- N118 (= N121) binding Mg(2+)
- V120 (≠ I123) binding Mg(2+)
- GL 122:123 (≠ GM 125:126) binding thiamine diphosphate
- C197 (= C200) binding [4Fe-4S] cluster
Q96Y68 2-oxoacid:ferredoxin oxidoreductase 1, subunit beta; OFOR1; EC 1.2.7.11 from Sulfurisphaera tokodaii (strain DSM 16993 / JCM 10545 / NBRC 100140 / 7) (Sulfolobus tokodaii) (see 2 papers)
39% identity, 90% coverage: 16:254/267 of query aligns to 11:266/305 of Q96Y68
- C12 (= C17) binding [4Fe-4S] cluster
- C15 (= C20) binding [4Fe-4S] cluster
- C46 (= C51) binding [4Fe-4S] cluster
- K49 (≠ R54) mutation to I: Loss of oxidoreductase activity toward 2-oxoglutarate but retains its activity toward pyruvate.
- D90 (= D93) binding Mg(2+)
- GD 91:92 (= GD 94:95) binding thiamine diphosphate
- N118 (= N121) binding Mg(2+)
- V120 (≠ I123) binding Mg(2+)
- GL 122:123 (≠ GM 125:126) binding thiamine diphosphate
- K125 (≠ G128) Plays an important role in the binding of CoA; mutation to A: Shows a strong decrease of affinity for CoA and a poor inactivation by 4-fluoro-7-nitrobenzofurazan (NBD-F).
- K173 (= K176) mutation to A: Same oxidoreductase activity as the wild-type.
- C197 (= C200) binding [4Fe-4S] cluster
P72579 2-oxoacid:ferredoxin oxidoreductase subunit beta; OFOR; EC 1.2.7.11 from Sulfolobus sp. (see paper)
39% identity, 90% coverage: 16:254/267 of query aligns to 11:266/305 of P72579
- K49 (≠ R54) mutation to I: Strong decrease of the oxidoreductase activity with pyruvate, 2-oxobutyrate and 2-oxoglutarate.; mutation to R: Increase the oxidoreductase activity with pyruvate.; mutation to V: Slight decrease of the oxidoreductase activity with pyruvate, 2-oxobutyrate and 2-oxoglutarate.
- L123 (≠ M126) mutation L->A,I: Strong decrease of the oxidoreductase activity with pyruvate, 2-oxobutyrate and 2-oxoglutarate.; mutation to N: Strong decrease of the oxidoreductase activity with pyruvate and 2-oxobutyrate. However, this mutant shows almost the same activity with 2-oxoglutarate as the wild-type.
5b48B 2-oxoacid:ferredoxin oxidoreductase 1 from sulfolobus tokodai (see paper)
39% identity, 90% coverage: 16:254/267 of query aligns to 7:248/286 of 5b48B
- binding magnesium ion: D84 (= D93), N112 (= N121), V114 (≠ I123)
- binding iron/sulfur cluster: C8 (= C17), C11 (= C20), C42 (= C51), C183 (= C200), T185 (= T202)
- binding 2-[(2E)-3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-2-(1-oxidanylpropylidene)-1,3-thiazol-5-yl]ethyl phosphono hydrogen phosphate: I40 (= I49), G41 (= G50), C42 (= C51), S43 (= S52), H59 (= H68), G85 (= G94), D86 (= D95), N112 (= N121), V114 (≠ I123), Y115 (= Y124), G116 (= G125), L117 (≠ M126)
5b47B 2-oxoacid:ferredoxin oxidoreductase 2 from sulfolobus tokodai - pyruvate complex (see paper)
43% identity, 70% coverage: 16:203/267 of query aligns to 4:182/275 of 5b47B
- binding magnesium ion: D83 (= D93), N111 (= N121)
- binding iron/sulfur cluster: C5 (= C17), C8 (= C20), C39 (= C51), C179 (= C200)
- binding thiamine diphosphate: I37 (= I49), G38 (= G50), C39 (= C51), S40 (= S52), H58 (= H68), G84 (= G94), D85 (= D95), N111 (= N121), V113 (≠ I123), Y114 (= Y124), L116 (≠ M126)
6a50A Structure of benzoylformate decarboxylases in complex with cofactor tpp
31% identity, 50% coverage: 69:201/267 of query aligns to 404:526/527 of 6a50A
- binding magnesium ion: D428 (= D93), N455 (= N121), T457 (≠ I123)
- binding thiamine diphosphate: G427 (= G92), D428 (= D93), G429 (= G94), S430 (≠ D95), Y433 (≠ H103), N455 (= N121), T457 (≠ I123), Y458 (= Y124), G459 (= G125), M460 (= M126), L461 (≠ T127)
Sites not aligning to the query:
3f6bX Crystal structure of benzoylformate decarboxylase in complex with the pyridyl inhibitor paa (see paper)
31% identity, 50% coverage: 69:201/267 of query aligns to 403:525/525 of 3f6bX
Sites not aligning to the query:
- active site: 24, 46, 108, 109, 110, 111, 400
- binding 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-2-[(1S,2E)-1-hydroxy-3-pyridin-3-ylprop-2-en-1-yl]-4-methyl-1,3-thiazol-3-ium: 22, 23, 24, 25, 46, 69
3fznA Intermediate analogue in benzoylformate decarboxylase (see paper)
31% identity, 48% coverage: 69:196/267 of query aligns to 403:520/523 of 3fznA
- active site: D427 (= D93), N454 (= N121), T456 (≠ I123), Y457 (= Y124), A459 (≠ M126), L460 (≠ T127), F463 (≠ Q130)
- binding 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-{(S)-hydroxy[(R)-hydroxy(methoxy)phosphoryl]phenylmethyl}-5-(2-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium: G426 (= G92), D427 (= D93), G428 (= G94), S429 (≠ D95), Y432 (≠ H103), N454 (= N121), T456 (≠ I123), Y457 (= Y124), G458 (= G125), A459 (≠ M126)
- binding magnesium ion: D427 (= D93), N454 (= N121), T456 (≠ I123)
Sites not aligning to the query:
- active site: 22, 24, 25, 26, 27, 46, 69, 108, 109, 110, 111, 159, 253, 280, 375, 400, 402
- binding 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-{(S)-hydroxy[(R)-hydroxy(methoxy)phosphoryl]phenylmethyl}-5-(2-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium: 22, 23, 24, 25, 46, 69, 280, 376, 377, 400, 402
- binding phosphate ion: 286, 288, 289, 290
1bfdA Benzoylformate decarboxylase from pseudomonas putida (see paper)
31% identity, 48% coverage: 69:196/267 of query aligns to 403:520/523 of 1bfdA
- active site: D427 (= D93), N454 (= N121), T456 (≠ I123), Y457 (= Y124), A459 (≠ M126), L460 (≠ T127), F463 (≠ Q130)
- binding calcium ion: D427 (= D93), N454 (= N121), T456 (≠ I123)
- binding thiamine diphosphate: G426 (= G92), D427 (= D93), G428 (= G94), S429 (≠ D95), Y432 (≠ H103), T456 (≠ I123), Y457 (= Y124), G458 (= G125), A459 (≠ M126), L460 (≠ T127)
Sites not aligning to the query:
- active site: 22, 24, 25, 26, 27, 46, 69, 108, 109, 110, 111, 159, 253, 280, 375, 400, 402
- binding magnesium ion: 116, 117, 119
- binding thiamine diphosphate: 376, 377, 402
1pi3A E28q mutant benzoylformate decarboxylase from pseudomonas putida
31% identity, 48% coverage: 69:196/267 of query aligns to 403:520/523 of 1pi3A
- active site: D427 (= D93), N454 (= N121), T456 (≠ I123), Y457 (= Y124), A459 (≠ M126), L460 (≠ T127), F463 (≠ Q130)
- binding calcium ion: D427 (= D93), N454 (= N121), T456 (≠ I123)
- binding 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-2-oxo-2,3-dihydro-1,3-thiazol-5-yl}ethyl trihydrogendiphosphate: G426 (= G92), G428 (= G94), S429 (≠ D95), Y432 (≠ H103), N454 (= N121), T456 (≠ I123), Y457 (= Y124), G458 (= G125), A459 (≠ M126), L460 (≠ T127)
Sites not aligning to the query:
- active site: 22, 24, 25, 26, 27, 46, 69, 108, 109, 110, 111, 159, 253, 280, 375, 400, 402
- binding magnesium ion: 116, 117, 119
- binding 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-2-oxo-2,3-dihydro-1,3-thiazol-5-yl}ethyl trihydrogendiphosphate: 376, 377, 402
5deiA Benzoylformate decarboxylase from pseudomonas putida
31% identity, 48% coverage: 69:196/267 of query aligns to 403:520/524 of 5deiA
- active site: D427 (= D93), N454 (= N121), T456 (≠ I123), Y457 (= Y124), A459 (≠ M126), L460 (≠ T127), F463 (≠ Q130)
- binding calcium ion: D427 (= D93), N454 (= N121), T456 (≠ I123)
- binding thiamine diphosphate: G426 (= G92), D427 (= D93), G428 (= G94), S429 (≠ D95), Y432 (≠ H103), T456 (≠ I123), Y457 (= Y124), G458 (= G125), A459 (≠ M126), L460 (≠ T127)
Sites not aligning to the query:
- active site: 22, 24, 25, 26, 27, 46, 69, 108, 109, 110, 111, 159, 253, 280, 375, 400, 402, 524
- binding bicarbonate ion: 25, 69, 109
- binding calcium ion: 185, 186
- binding magnesium ion: 116, 117, 119
- binding thiamine diphosphate: 22, 23, 46, 69, 376, 377, 402
3fsjX Crystal structure of benzoylformate decarboxylase in complex with the inhibitor mbp (see paper)
31% identity, 48% coverage: 69:196/267 of query aligns to 403:520/524 of 3fsjX
- active site: D427 (= D93), N454 (= N121), T456 (≠ I123), Y457 (= Y124), A459 (≠ M126), L460 (≠ T127)
- binding calcium ion: D427 (= D93), N454 (= N121), T456 (≠ I123)
- binding 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-{(S)-hydroxy[(R)-hydroxy(methoxy)phosphoryl]phenylmethyl}-5-(2-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium: G426 (= G92), D427 (= D93), G428 (= G94), S429 (≠ D95), Y432 (≠ H103), T456 (≠ I123), Y457 (= Y124), G458 (= G125), A459 (≠ M126), L460 (≠ T127), F463 (≠ Q130)
Sites not aligning to the query:
- active site: 24, 25, 27, 46, 69, 108, 109, 110, 111, 280, 400, 524
- binding 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-{(S)-hydroxy[(R)-hydroxy(methoxy)phosphoryl]phenylmethyl}-5-(2-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium: 280, 376, 377, 396, 400, 402, 523, 524
1mczA Benzoylformate decarboxylase from pseudomonas putida complexed with an inhibitor, r-mandelate (see paper)
31% identity, 48% coverage: 69:196/267 of query aligns to 403:520/524 of 1mczA
- active site: D427 (= D93), N454 (= N121), T456 (≠ I123), Y457 (= Y124), A459 (≠ M126), L460 (≠ T127), F463 (≠ Q130)
- binding magnesium ion: D427 (= D93), N454 (= N121), T456 (≠ I123)
- binding (r)-mandelic acid: F463 (≠ Q130)
- binding thiamine diphosphate: G426 (= G92), D427 (= D93), G428 (= G94), S429 (≠ D95), Y432 (≠ H103), Y457 (= Y124), G458 (= G125), A459 (≠ M126), L460 (≠ T127)
Sites not aligning to the query:
- active site: 22, 24, 25, 26, 27, 46, 69, 108, 109, 110, 111, 159, 253, 280, 375, 400, 402, 524
- binding magnesium ion: 116, 117, 119
- binding (r)-mandelic acid: 25, 69, 109, 280, 376
- binding thiamine diphosphate: 22, 23, 46, 69, 376, 377, 400, 402
Query Sequence
>WP_078717693.1 NCBI__GCF_900167125.1:WP_078717693.1
MAFRDLIRERFFPHIWCPGCGHGTVLNSLLHVVDKLGLDPTSMCMVSGIGCSARISGYVD
FHTMHTMHGRALPCATGIKMTKPELNVVVPMGDGDAMAIGGNHFIHACRRNIDMTAIVLN
NRIYGMTGGQYSPLSGRGVLATTAPYRSIDDDFDAVELARGAGATFVARTTAFHVKELSK
ILTKAIEHKGFSVVEVMVQCPTYFGRKNKMGGAVQLLEYYRDNTAPLGSKKLEENQNLIP
RGVFVERERPEYCEEYQNVIALAEGKE
Or try a new SitesBLAST search
SitesBLAST's Database
SitesBLAST's database includes
(1) SwissProt
entries with experimentally-supported functional features;
and (2) protein structures with bound ligands, from the
BioLip database.
by Morgan Price,
Arkin group
Lawrence Berkeley National Laboratory