SitesBLAST
Comparing 15516 b1394 enoyl-CoA hydratase (NCBI) 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)
6slbAAA Enoyl-CoA hydratase/carnithine racemase (see paper)
45% identity, 99% coverage: 4:262/262 of query aligns to 4:257/257 of 6slbAAA
- active site: Q64 (= Q64), F69 (vs. gap), L80 (≠ V84), N84 (= N89), A108 (= A113), S111 (≠ T116), A130 (= A135), F131 (= F136), L136 (= L141), P138 (= P143), D139 (= D144), A224 (≠ D229), G234 (= G239)
- binding (~{E})-6-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-6-oxidanylidene-hex-3-enoic acid: L24 (= L24), A26 (≠ S26), R58 (= R58), A62 (= A62), G63 (= G63), Q64 (= Q64), D65 (= D65), L66 (= L66), Y76 (≠ L80), H79 (≠ S83), Y83 (= Y88), V104 (= V109), A106 (= A111), G107 (= G112), A108 (= A113), A130 (= A135), F131 (= F136), I134 (≠ L139), D139 (= D144)
6slaAAA Enoyl-CoA hydratase/carnithine racemase (see paper)
44% identity, 99% coverage: 4:262/262 of query aligns to 1:245/245 of 6slaAAA
- active site: Q61 (= Q64), L68 (≠ V71), N72 (= N89), A96 (= A113), S99 (≠ T116), A118 (= A135), F119 (= F136), L124 (= L141), P126 (= P143), N127 (≠ D144), A212 (≠ D229), G222 (= G239)
- binding ~{S}-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethyl] 2-(2,5-dihydrooxepin-7-yl)ethanethioate: K20 (≠ R23), L21 (= L24), A23 (≠ S26), R55 (= R58), A59 (= A62), G60 (= G63), Q61 (= Q64), D62 (= D65), L63 (= L66), L68 (≠ V71), Y71 (= Y88), V92 (= V109), A94 (= A111), G95 (= G112), A96 (= A113), A118 (= A135), F119 (= F136), I122 (≠ L139), L124 (= L141), N127 (≠ D144), F234 (= F251), K237 (= K254)
5zaiC Crystal structure of 3-hydroxypropionyl-coa dehydratase from metallosphaera sedula (see paper)
35% identity, 100% coverage: 2:262/262 of query aligns to 1:259/259 of 5zaiC
- active site: A65 (≠ Q64), F70 (≠ R69), S82 (≠ E85), R86 (≠ N89), G110 (≠ A113), E113 (≠ T116), P132 (≠ A135), E133 (≠ F136), I138 (≠ L141), P140 (= P143), G141 (≠ D144), A226 (≠ D229), F236 (≠ G239)
- binding coenzyme a: D23 (≠ E22), K24 (≠ R23), L25 (= L24), A27 (≠ S26), A63 (= A62), G64 (= G63), A65 (≠ Q64), D66 (= D65), I67 (≠ L66), L108 (≠ A111), G109 (= G112), P132 (≠ A135), E133 (≠ F136), R166 (≠ Q169), F248 (= F251), K251 (= K254)
3q0gD Crystal structure of the mycobacterium tuberculosis crotonase bound to a reaction intermediate derived from crotonyl coa
33% identity, 98% coverage: 3:260/262 of query aligns to 3:250/250 of 3q0gD
- active site: A64 (≠ Q64), M69 (≠ R69), T75 (≠ S83), F79 (= F87), G103 (≠ A113), E106 (≠ T116), P125 (≠ A135), E126 (≠ F136), V131 (≠ L141), P133 (= P143), G134 (≠ D144), L219 (≠ D229), F229 (≠ G239)
- binding Butyryl Coenzyme A: F225 (≠ Q235), F241 (= F251), K244 (= K254)
2hw5C The crystal structure of human enoyl-coenzyme a (coa) hydratase short chain 1, echs1
32% identity, 93% coverage: 16:259/262 of query aligns to 20:257/260 of 2hw5C
- active site: A68 (≠ Q64), M73 (≠ R69), S83 (≠ N89), L87 (≠ R93), G111 (≠ A113), E114 (≠ T116), P133 (≠ A135), E134 (≠ F136), T139 (≠ L141), P141 (= P143), G142 (≠ D144), K227 (≠ D229), F237 (≠ G239)
- binding crotonyl coenzyme a: K26 (≠ E22), A27 (≠ R23), L28 (= L24), A30 (≠ S26), K62 (≠ R58), A66 (= A62), A68 (≠ Q64), D69 (= D65), I70 (≠ L66), K71 (≠ N67), Y107 (≠ V109), F109 (≠ A111)
3q0jA Crystal structure of the mycobacterium tuberculosis crotonase in complex with the inhibitor acetoacetylcoa
33% identity, 98% coverage: 3:260/262 of query aligns to 4:255/255 of 3q0jA
- active site: A65 (≠ Q64), M70 (≠ R69), T80 (≠ Y88), F84 (≠ V92), G108 (≠ A113), E111 (≠ T116), P130 (≠ A135), E131 (≠ F136), V136 (≠ L141), P138 (= P143), G139 (≠ D144), L224 (≠ D229), F234 (≠ G239)
- binding acetoacetyl-coenzyme a: F246 (= F251), K249 (= K254)
3q0gC Crystal structure of the mycobacterium tuberculosis crotonase bound to a reaction intermediate derived from crotonyl coa
33% identity, 98% coverage: 3:260/262 of query aligns to 4:255/255 of 3q0gC
- active site: A65 (≠ Q64), M70 (≠ R69), T80 (≠ Y88), F84 (≠ V92), G108 (≠ A113), E111 (≠ T116), P130 (≠ A135), E131 (≠ F136), V136 (≠ L141), P138 (= P143), G139 (≠ D144), L224 (≠ D229), F234 (≠ G239)
- binding coenzyme a: A24 (≠ R23), L25 (= L24), A27 (≠ S26), A63 (= A62), A65 (≠ Q64), D66 (= D65), I67 (≠ L66), K68 (≠ N67), Y104 (≠ V109), P130 (≠ A135), E131 (≠ F136), L134 (= L139)
3h81A Crystal structure of enoyl-coa hydratase from mycobacterium tuberculosis (see paper)
32% identity, 99% coverage: 3:262/262 of query aligns to 3:256/256 of 3h81A
- active site: A64 (≠ Q64), M69 (≠ R69), T79 (≠ Y88), F83 (≠ V92), G107 (≠ A113), E110 (≠ T116), P129 (≠ A135), E130 (≠ F136), V135 (≠ L141), P137 (= P143), G138 (≠ D144), L223 (≠ D229), F233 (≠ G239)
- binding calcium ion: R171 (≠ E177), S172 (≠ W178), F233 (≠ G239), Q238 (≠ Y244)
1mj3A Crystal structure analysis of rat enoyl-coa hydratase in complex with hexadienoyl-coa (see paper)
32% identity, 93% coverage: 16:259/262 of query aligns to 20:255/258 of 1mj3A
- active site: A68 (≠ Q64), M73 (≠ R69), S83 (≠ N89), L85 (= L91), G109 (≠ A113), E112 (≠ T116), P131 (≠ A135), E132 (≠ F136), T137 (≠ L141), P139 (= P143), G140 (≠ D144), K225 (≠ D229), F235 (≠ G239)
- binding hexanoyl-coenzyme a: K26 (≠ E22), A27 (≠ R23), L28 (= L24), A30 (≠ S26), K62 (≠ R58), A66 (= A62), G67 (= G63), A68 (≠ Q64), D69 (= D65), I70 (≠ L66), K71 (≠ N67), M73 (≠ R69), W88 (vs. gap), Y105 (≠ V109), L107 (≠ A111), G108 (= G112), G109 (≠ A113), E112 (≠ T116), P131 (≠ A135), E132 (≠ F136), L135 (= L139), G140 (≠ D144), A141 (≠ C145), F231 (≠ Q235), F247 (= F251), K250 (= K254)
2dubA Enoyl-coa hydratase complexed with octanoyl-coa (see paper)
32% identity, 93% coverage: 16:259/262 of query aligns to 19:251/254 of 2dubA
- active site: A67 (≠ Q64), M72 (= M82), S82 (≠ V92), G105 (≠ A113), E108 (≠ T116), P127 (≠ A135), E128 (≠ F136), T133 (≠ L141), P135 (= P143), G136 (≠ D144), K221 (≠ D229), F231 (≠ G239)
- binding octanoyl-coenzyme a: K25 (≠ E22), A26 (≠ R23), L27 (= L24), A29 (≠ S26), K61 (≠ R58), A65 (= A62), G66 (= G63), A67 (≠ Q64), D68 (= D65), I69 (≠ L66), K70 (≠ N67), Y101 (≠ V109), G104 (= G112), G105 (≠ A113), E108 (≠ T116), P127 (≠ A135), E128 (≠ F136), L131 (= L139), P135 (= P143), G136 (≠ D144), A137 (≠ C145)
1dubA 2-enoyl-coa hydratase, data collected at 100 k, ph 6.5 (see paper)
32% identity, 93% coverage: 16:259/262 of query aligns to 20:257/260 of 1dubA
- active site: A68 (≠ Q64), M73 (≠ R69), S83 (≠ L80), L87 (≠ V84), G111 (≠ A113), E114 (≠ T116), P133 (≠ A135), E134 (≠ F136), T139 (≠ L141), P141 (= P143), G142 (≠ D144), K227 (≠ D229), F237 (≠ G239)
- binding acetoacetyl-coenzyme a: K26 (≠ E22), A27 (≠ R23), L28 (= L24), A30 (≠ S26), K62 (≠ R58), A66 (= A62), G67 (= G63), A68 (≠ Q64), D69 (= D65), I70 (≠ L66), K71 (≠ N67), M73 (≠ R69), Y107 (≠ V109), L109 (≠ A111), G110 (= G112), G111 (≠ A113), E114 (≠ T116), P133 (≠ A135), E134 (≠ F136), L137 (= L139), G142 (≠ D144), F233 (≠ Q235), F249 (= F251), K252 (= K254)
1ey3A Structure of enoyl-coa hydratase complexed with the substrate dac-coa (see paper)
32% identity, 93% coverage: 16:259/262 of query aligns to 18:255/258 of 1ey3A
- active site: A66 (≠ Q64), M71 (≠ R69), S81 (≠ L80), L85 (≠ V84), G109 (≠ A113), E112 (≠ T116), P131 (≠ A135), E132 (≠ F136), T137 (≠ L141), P139 (= P143), G140 (≠ D144), K225 (≠ D229), F235 (≠ G239)
- binding 4-(n,n-dimethylamino)cinnamoyl-coa: K24 (≠ E22), A25 (≠ R23), L26 (= L24), A28 (≠ S26), A64 (= A62), G65 (= G63), A66 (≠ Q64), D67 (= D65), I68 (≠ L66), K69 (≠ N67), L85 (≠ V84), W88 (≠ F87), Y105 (≠ V109), L107 (≠ A111), G108 (= G112), G109 (≠ A113), P131 (≠ A135), E132 (≠ F136), L135 (= L139), G140 (≠ D144), A141 (≠ C145), R165 (≠ Q169), F231 (≠ Q235), F247 (= F251), K250 (= K254)
P14604 Enoyl-CoA hydratase, mitochondrial; mECH; mECH1; Enoyl-CoA hydratase 1; ECHS1; Short-chain enoyl-CoA hydratase; SCEH; EC 4.2.1.17; EC 5.3.3.8 from Rattus norvegicus (Rat) (see 3 papers)
32% identity, 93% coverage: 16:259/262 of query aligns to 50:287/290 of P14604
- E144 (≠ T116) mutation to D: Reduces activity 50-fold.; mutation to Q: Reduces activity 3300-fold.
- E164 (≠ F136) mutation to D: Reduces activity 1250-fold.; mutation to Q: Reduces activity 330000-fold.
Sites not aligning to the query:
- 1:29 modified: transit peptide, Mitochondrion
1nzyB 4-chlorobenzoyl coenzyme a dehalogenase from pseudomonas sp. Strain cbs-3 (see paper)
30% identity, 88% coverage: 1:231/262 of query aligns to 1:232/269 of 1nzyB
- active site: C61 (= C61), F64 (≠ Q64), I69 (≠ R69), A86 (≠ E85), H90 (≠ N89), G114 (≠ A113), G117 (≠ T116), A136 (= A135), W137 (≠ F136), I142 (≠ L141), N144 (≠ P143), D145 (= D144), E230 (≠ D229)
- binding 4-hydroxybenzoyl coenzyme a: R22 (≠ E22), H23 (≠ R23), R24 (≠ L24), A26 (≠ S26), A62 (= A62), G63 (= G63), F64 (≠ Q64), Y65 (≠ D65), L66 (= L66), R67 (≠ N67), W89 (≠ Y88), A112 (= A111), G113 (= G112), G114 (≠ A113), A136 (= A135), W137 (≠ F136), I140 (≠ L139), I142 (≠ L141), D145 (= D144), T146 (≠ C145)
- binding calcium ion: G49 (≠ R49), L202 (= L201), A203 (= A202), A205 (≠ Q204), T207 (= T206), Q210 (≠ L209)
- binding phosphate ion: E57 (≠ G57), D58 (≠ R58), N108 (= N107), K188 (≠ D187), F191 (≠ L190), R192 (≠ A191)
Sites not aligning to the query:
1jxzB Structure of the h90q mutant of 4-chlorobenzoyl-coenzyme a dehalogenase complexed with 4-hydroxybenzoyl-coenzyme a (product) (see paper)
30% identity, 88% coverage: 1:231/262 of query aligns to 1:232/269 of 1jxzB
- active site: C61 (= C61), F64 (≠ Q64), I69 (≠ R69), A86 (≠ E85), Q90 (≠ N89), G113 (= G112), G114 (≠ A113), G117 (≠ T116), A136 (= A135), W137 (≠ F136), I142 (≠ L141), N144 (≠ P143), D145 (= D144), E230 (≠ D229)
- binding 4-hydroxybenzoyl coenzyme a: R22 (≠ E22), H23 (≠ R23), R24 (≠ L24), A26 (≠ S26), A62 (= A62), G63 (= G63), F64 (≠ Q64), Y65 (≠ D65), L66 (= L66), R67 (≠ N67), A86 (≠ E85), W89 (≠ Y88), G113 (= G112), G114 (≠ A113), A136 (= A135), W137 (≠ F136), I140 (≠ L139), I142 (≠ L141), D145 (= D144), T146 (≠ C145)
- binding calcium ion: G49 (≠ R49), L202 (= L201), A203 (= A202), A205 (≠ Q204), T207 (= T206), Q210 (≠ L209)
Sites not aligning to the query:
A5JTM5 4-chlorobenzoyl coenzyme A dehalogenase; 4-CBA-CoA dehalogenase; 4-CBCoA dehalogenase; 4-chlorobenzoyl-CoA dehalogenase; EC 3.8.1.7 from Pseudomonas sp. (strain CBS-3) (see 7 papers)
30% identity, 88% coverage: 1:231/262 of query aligns to 1:232/269 of A5JTM5