SitesBLAST
Comparing Pf6N2E2_1004 3-oxoacyl-[acyl-carrier protein] reductase (EC 1.1.1.100) 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)
1nfqA Rv2002 gene product from mycobacterium tuberculosis (see paper)
44% identity, 93% coverage: 14:248/252 of query aligns to 3:236/244 of 1nfqA
- active site: G17 (= G28), S139 (= S146), Y152 (= Y159), K156 (= K163)
- binding Androsterone: L91 (≠ V97), E141 (≠ W148), C149 (≠ V156), Y152 (= Y159), V193 (≠ Q200), I197 (= I204), F198 (≠ T205)
- binding 1,4-dihydronicotinamide adenine dinucleotide: R16 (≠ M27), G17 (= G28), M18 (≠ I29), D37 (= D48), L39 (≠ H50), L59 (= L65), D60 (= D66), V61 (= V67), N87 (= N93), A88 (= A94), I137 (≠ V144), S139 (= S146), Y152 (= Y159), K156 (= K163), P182 (= P189), V185 (= V192), T187 (= T194), P188 (= P195), M189 (= M196), T190 (≠ I197)
1nffA Crystal structure of rv2002 gene product from mycobacterium tuberculosis (see paper)
44% identity, 93% coverage: 14:248/252 of query aligns to 3:236/244 of 1nffA
- active site: G17 (= G28), S139 (= S146), Y152 (= Y159), K156 (= K163)
- binding nicotinamide-adenine-dinucleotide: G13 (= G24), R16 (≠ M27), G17 (= G28), M18 (≠ I29), D37 (= D48), I38 (≠ V49), L39 (≠ H50), L59 (= L65), D60 (= D66), V61 (= V67), N87 (= N93), A88 (= A94), G89 (= G95), I90 (≠ L96), I137 (≠ V144), S139 (= S146), Y152 (= Y159), K156 (= K163), P182 (= P189), V185 (= V192), T187 (= T194), P188 (= P195), M189 (= M196), T190 (≠ I197)
P9WGT1 3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase; NADH-dependent 3alpha, 20beta-hydroxysteroid dehydrogenase; EC 1.1.1.53 from Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) (see paper)
44% identity, 93% coverage: 14:248/252 of query aligns to 4:237/260 of P9WGT1
- I6 (≠ H16) mutation to T: Maximal improvement in solubility; when associated with M-47 and K-69.
- RGM 17:19 (≠ MGI 27:29) binding
- D38 (= D48) binding
- V47 (≠ N57) mutation to M: Maximal improvement in solubility; when associated with T-6 and K-69.
- DV 61:62 (= DV 66:67) binding
- T69 (≠ E74) mutation to K: Maximal improvement in solubility; when associated with T-6 and M-47.
- N88 (= N93) binding
- S140 (= S146) mutation to A: Complete loss of both oxidation of androsterone and reduction of progesterone; when associated with T6; M-47 and K-69.
- Y153 (= Y159) binding ; mutation to F: Complete loss of both oxidation of androsterone and reduction of progesterone; when associated with T6; M-47 and K-69.
- K157 (= K163) binding
- 183:191 (vs. 189:197, 78% identical) binding
6ixmC Crystal structure of the ketone reductase chkred20 from the genome of chryseobacterium sp. Ca49 complexed with NAD (see paper)
40% identity, 94% coverage: 15:250/252 of query aligns to 3:246/248 of 6ixmC
- active site: G16 (= G28), S142 (= S146), Y155 (= Y159), K159 (= K163)
- binding nicotinamide-adenine-dinucleotide: G12 (= G24), S15 (≠ M27), G16 (= G28), I17 (= I29), D36 (= D48), I37 (≠ V49), A61 (≠ L65), D62 (= D66), T63 (≠ V67), N89 (= N93), A90 (= A94), M140 (≠ V144), S142 (= S146), Y155 (= Y159), K159 (= K163), P185 (= P189), A186 (≠ G190), Y187 (≠ L191), I188 (≠ V192), L192 (≠ M196)
1zk1A Structure of r-specific alcohol dehydrogenase (mutant g37d) from lactobacillus brevis in complex with phenylethanol and NAD (see paper)
42% identity, 94% coverage: 14:250/252 of query aligns to 3:249/251 of 1zk1A
- active site: G17 (= G28), S142 (= S146), Y155 (= Y159), K159 (= K163)
- binding 1-phenylethanone: A93 (≠ V97), N95 (≠ S99), Y155 (= Y159), Y189 (≠ L191)
- binding nicotinamide-adenine-dinucleotide: G13 (= G24), L16 (≠ M27), I18 (= I29), D37 (= D48), H61 (≠ L65), D62 (= D66), S63 (≠ V67), N89 (= N93), A90 (= A94), I92 (≠ L96), M140 (≠ V144), Y155 (= Y159), G188 (= G190), I190 (≠ V192), L194 (≠ M196)
1zjzA Structure of r-specific alcohol dehydrogenase (mutant g37d) from lactobacillus brevis in complex with phenylethanol and NAD (see paper)
42% identity, 94% coverage: 14:250/252 of query aligns to 3:249/251 of 1zjzA
- active site: G17 (= G28), S142 (= S146), Y155 (= Y159), K159 (= K163)
- binding nicotinamide-adenine-dinucleotide: G13 (= G24), L16 (≠ M27), I18 (= I29), D37 (= D48), D62 (= D66), N89 (= N93), A90 (= A94), G91 (= G95), I92 (≠ L96), Y155 (= Y159), G188 (= G190), I190 (≠ V192), L194 (≠ M196)
- binding (1r)-1-phenylethanol: A93 (≠ V97), N95 (≠ S99), L152 (≠ V156), Y155 (= Y159)
1zjyA Structure of r-specific alcohol dehydrogenase (mutant g37d) from lactobacillus brevis in complex with phenylethanol and nadh (see paper)
42% identity, 94% coverage: 14:250/252 of query aligns to 3:249/251 of 1zjyA
- active site: G17 (= G28), S142 (= S146), Y155 (= Y159), K159 (= K163)
- binding 1,4-dihydronicotinamide adenine dinucleotide: G13 (= G24), L16 (≠ M27), G17 (= G28), I18 (= I29), D37 (= D48), D62 (= D66), N89 (= N93), A90 (= A94), G91 (= G95), I92 (≠ L96), Y155 (= Y159), G188 (= G190), I190 (≠ V192), L194 (≠ M196)
- binding (1r)-1-phenylethanol: A93 (≠ V97), N95 (≠ S99), L152 (≠ V156), Y155 (= Y159), Y189 (≠ L191)
Q6WVP7 NADP-dependent (R)-specific alcohol dehydrogenase; (R)-specific ADH; Ketoreductase; KRED; EC 1.1.1.- from Lentilactobacillus kefiri (Lactobacillus kefiri) (see paper)
42% identity, 94% coverage: 14:250/252 of query aligns to 4:250/252 of Q6WVP7
Sites not aligning to the query:
1zk4A Structure of r-specific alcohol dehydrogenase (wildtype) from lactobacillus brevis in complex with acetophenone and NADP (see paper)
41% identity, 94% coverage: 14:250/252 of query aligns to 3:249/251 of 1zk4A
- active site: G17 (= G28), S142 (= S146), Y155 (= Y159), K159 (= K163)
- binding 1-phenylethanone: A93 (≠ V97), Y155 (= Y159), Y189 (≠ L191)
- binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G24), T15 (≠ G26), L16 (≠ M27), I18 (= I29), T36 (≠ G47), G37 (≠ D48), R38 (≠ V49), H61 (≠ L65), D62 (= D66), N89 (= N93), A90 (= A94), G91 (= G95), I92 (≠ L96), Y155 (= Y159), G188 (= G190), I190 (≠ V192), T192 (= T194), L194 (≠ M196)
7ejhA Crystal structure of kred mutant-f147l/l153q/y190p/l199a/m205f/m206f and 2-hydroxyisoindoline-1,3-dione complex
42% identity, 94% coverage: 14:250/252 of query aligns to 5:251/253 of 7ejhA
- binding 2-oxidanylisoindole-1,3-dione: S144 (= S146), I145 (= I147), E146 (≠ W148), Y157 (= Y159), V197 (≠ I197), F207 (≠ A206)
- binding nadp nicotinamide-adenine-dinucleotide phosphate: G15 (= G24), T17 (≠ G26), I20 (= I29), R40 (≠ V49), H41 (= H50), D64 (= D66), A65 (≠ V67), N91 (= N93), A92 (= A94), V114 (≠ I117), M142 (≠ V144), S144 (= S146), Y157 (= Y159), K161 (= K163), P189 (= P189), G190 (= G190), P191 (≠ L191), I192 (≠ V192), T194 (= T194), P195 (= P195), L196 (≠ M196)
7ejiB Crystal structure of kred f147l/l153q/y190p/l199a/m205f/m206f variant and methyl methacrylate complex
42% identity, 94% coverage: 14:250/252 of query aligns to 3:249/251 of 7ejiB
- binding methyl 2-methylprop-2-enoate: S142 (= S146), I143 (= I147), Y155 (= Y159), F205 (≠ A206)
- binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G24), T15 (≠ G26), L16 (≠ M27), G17 (= G28), I18 (= I29), R38 (≠ V49), H39 (= H50), D62 (= D66), A63 (≠ V67), N89 (= N93), A90 (= A94), V112 (≠ I117), M140 (≠ V144), S142 (= S146), Y155 (= Y159), K159 (= K163), P187 (= P189), P189 (≠ L191), I190 (≠ V192), T192 (= T194), P193 (= P195), L194 (≠ M196)
6y0sAAA R-specific alcohol dehydrogenase (see paper)
41% identity, 94% coverage: 14:250/252 of query aligns to 3:249/251 of 6y0sAAA
2hsdA The refined three-dimensional structure of 3alpha,20beta- hydroxysteroid dehydrogenase and possible roles of the residues conserved in short-chain dehydrogenases (see paper)
43% identity, 94% coverage: 15:251/252 of query aligns to 3:243/253 of 2hsdA
- active site: G16 (= G28), S138 (= S146), Y151 (= Y159), K155 (= K163)
- binding nicotinamide-adenine-dinucleotide: G12 (= G24), R15 (≠ M27), G16 (= G28), L17 (≠ I29), D36 (= D48), V37 (= V49), L58 (= L65), V60 (= V67), N86 (= N93), A87 (= A94), S138 (= S146), Y151 (= Y159), K155 (= K163), P181 (= P189), G182 (= G190), T184 (≠ V192)
1hdcA Mechanism of inhibition of 3alpha,20beta-hydroxysteroid dehydrogenase by a licorice-derived steroidal inhibitor (see paper)
43% identity, 94% coverage: 15:251/252 of query aligns to 3:243/253 of 1hdcA
- active site: G16 (= G28), S138 (= S146), Y151 (= Y159), K155 (= K163)
- binding carbenoxolone: S90 (vs. gap), T91 (≠ V97), G92 (= G98), L147 (≠ G155), Y151 (= Y159), M183 (≠ L191), M188 (= M196), T189 (≠ I197), T192 (≠ Q200)
4urfB Molecular genetic and crystal structural analysis of 1-(4- hydroxyphenyl)-ethanol dehydrogenase from aromatoleum aromaticum ebn1 (see paper)
38% identity, 93% coverage: 15:249/252 of query aligns to 3:245/248 of 4urfB
- active site: G16 (= G28), S142 (= S146), I152 (≠ V156), Y155 (= Y159), K159 (= K163)
- binding 3-pyridinium-1-ylpropane-1-sulfonate: L210 (≠ M214), R211 (≠ K215), R212 (= R216)
- binding bicarbonate ion: I92 (≠ L96), G94 (= G98), R109 (= R113), R179 (= R183), S228 (= S232)
- binding nicotinamide-adenine-dinucleotide: G12 (= G24), G14 (= G26), N15 (≠ M27), G16 (= G28), I17 (= I29), D36 (= D48), I37 (≠ V49), D62 (= D66), T63 (≠ V67), N89 (= N93), A90 (= A94), G91 (= G95), I140 (≠ V144), Y155 (= Y159), K159 (= K163), P185 (= P189), A186 (≠ G190), I188 (≠ V192), T190 (= T194)
4urfA Molecular genetic and crystal structural analysis of 1-(4- hydroxyphenyl)-ethanol dehydrogenase from aromatoleum aromaticum ebn1 (see paper)
38% identity, 93% coverage: 15:249/252 of query aligns to 3:245/248 of 4urfA
- active site: G16 (= G28), S142 (= S146), I152 (≠ V156), Y155 (= Y159), K159 (= K163)
- binding 3-pyridinium-1-ylpropane-1-sulfonate: I92 (≠ L96), S93 (≠ V97), G94 (= G98), E95 (≠ S99), T97 (≠ L101), E101 (= E105), T103 (= T107), Q106 (≠ D110), R109 (= R113), S175 (≠ A179), G177 (= G181)
- binding magnesium ion: S237 (≠ A241), Y238 (≠ E242)
- binding nicotinamide-adenine-dinucleotide: G12 (= G24), G14 (= G26), N15 (≠ M27), G16 (= G28), I17 (= I29), D36 (= D48), I37 (≠ V49), W41 (≠ E53), D62 (= D66), T63 (≠ V67), N89 (= N93), A90 (= A94), G91 (= G95), I140 (≠ V144), Y155 (= Y159), K159 (= K163), P185 (= P189), I188 (≠ V192), T190 (= T194)
4ureB Molecular genetic and crystal structural analysis of 1-(4- hydroxyphenyl)-ethanol dehydrogenase from aromatoleum aromaticum ebn1 (see paper)
38% identity, 93% coverage: 15:249/252 of query aligns to 3:245/248 of 4ureB
- active site: G16 (= G28), S142 (= S146), I152 (≠ V156), Y155 (= Y159), K159 (= K163)
- binding 3-pyridinium-1-ylpropane-1-sulfonate: N15 (≠ M27), G16 (= G28), I17 (= I29), N89 (= N93), G91 (= G95), Y155 (= Y159), P185 (= P189), A186 (≠ G190)
4bmsF Short chain alcohol dehydrogenase from ralstonia sp. Dsm 6428 in complex with NADPH
39% identity, 95% coverage: 12:250/252 of query aligns to 1:247/249 of 4bmsF
- active site: S137 (= S146), H147 (≠ V156), Y150 (= Y159), K154 (= K163), Q195 (vs. gap)
- binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G24), N15 (≠ G26), S16 (≠ M27), I18 (= I29), R38 (vs. gap), R39 (vs. gap), A59 (≠ L65), D60 (= D66), V61 (= V67), N87 (= N93), S88 (≠ A94), G89 (= G95), V110 (≠ I117), S137 (= S146), Y150 (= Y159), K154 (= K163), G181 (= G190), I183 (≠ V192), T185 (= T194), I187 (≠ M196)
2dtxA Structure of thermoplasma acidophilum aldohexose dehydrogenase (aldt) in complex with d-mannose (see paper)
39% identity, 94% coverage: 15:250/252 of query aligns to 5:246/255 of 2dtxA
2dteA Structure of thermoplasma acidophilum aldohexose dehydrogenase (aldt) in complex with nadh (see paper)
39% identity, 94% coverage: 15:250/252 of query aligns to 5:246/255 of 2dteA
- active site: G18 (= G28), S132 (= S146), Y145 (= Y159), S148 (= S162), K149 (= K163)
- binding 1,4-dihydronicotinamide adenine dinucleotide: G14 (= G24), S16 (≠ G26), M17 (= M27), G18 (= G28), I19 (= I29), S38 (≠ D48), I39 (≠ V49), C52 (≠ L65), D53 (= D66), V54 (= V67), N80 (= N93), A81 (= A94), I130 (≠ V144), S132 (= S146), Y145 (= Y159), K149 (= K163), P174 (= P189), A175 (≠ G190), T176 (≠ L191), I177 (≠ V192), T179 (= T194), P180 (= P195), L181 (≠ M196), V182 (≠ I197)
Query Sequence
>Pf6N2E2_1004 3-oxoacyl-[acyl-carrier protein] reductase (EC 1.1.1.100)
VIGKFQIRKINMKRLHNKVALVTGGGMGIGRAIAELFAEEGATVIVGDVHQPEPYKNDSV
VAKHLDVSKLEDWELLVAEVVREHGKVDVLVNNAGLVGSYLPIDEITLDDWNRVIDINQN
GVFYGMRTVVPVMKRQHAGSIVNVSSIWGIVGASGVSAYQASKAAVRMMSKNAALSYVAN
GIRVNSLHPGLVETPMIDRQAADITAAVVAATPMKRAADPKEIAYAALFLASDEASFITG
AELVVDGGYTTP
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