SitesBLAST
Comparing WP_011382625.1 NCBI__GCF_000009985.1:WP_011382625.1 to proteins with known functional sites using BLASTp with E ≤ 0.001.
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Found 20 (the maximum) hits to proteins with known functional sites (download)
6slbAAA Enoyl-CoA hydratase/carnithine racemase (see paper)
47% identity, 98% coverage: 5:261/261 of query aligns to 5:257/257 of 6slbAAA
- active site: Q64 (= Q63), F69 (≠ R68), L80 (= L83), N84 (= N88), A108 (= A112), S111 (≠ N115), A130 (≠ S134), F131 (= F135), L136 (= L140), P138 (= P142), D139 (= D143), A224 (≠ D228), G234 (= G238)
- 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: R58 (≠ K57), A62 (= A61), Q64 (= Q63), D65 (= D64), L66 (= L65), Y76 (≠ L79), A108 (= A112), F131 (= F135), D139 (= D143)
6slaAAA Enoyl-CoA hydratase/carnithine racemase (see paper)
45% identity, 98% coverage: 5:261/261 of query aligns to 2:245/245 of 6slaAAA
- active site: Q61 (= Q63), L68 (= L83), N72 (= N88), A96 (= A112), S99 (≠ N115), A118 (≠ S134), F119 (= F135), L124 (= L140), P126 (= P142), N127 (≠ D143), A212 (≠ D228), G222 (= G238)
- 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: L21 (≠ I24), A59 (= A61), Q61 (= Q63), D62 (= D64), L63 (= L65), L68 (= L83), Y71 (= Y87), A94 (= A110), G95 (= G111), A96 (= A112), F119 (= F135), I122 (≠ V138), L124 (= L140), N127 (≠ D143), F234 (= F250), K237 (= K253)
5zaiC Crystal structure of 3-hydroxypropionyl-coa dehydratase from metallosphaera sedula (see paper)
35% identity, 99% coverage: 3:261/261 of query aligns to 4:259/259 of 5zaiC
- active site: A65 (≠ Q63), F70 (≠ P72), S82 (≠ D84), R86 (≠ N88), G110 (≠ A112), E113 (≠ N115), P132 (≠ S134), E133 (≠ F135), I138 (≠ L140), P140 (= P142), G141 (≠ D143), A226 (≠ D228), F236 (≠ G238)
- binding coenzyme a: K24 (≠ R23), L25 (≠ I24), A63 (= A61), G64 (= G62), A65 (≠ Q63), D66 (= D64), I67 (≠ V69), P132 (≠ S134), R166 (≠ K168), F248 (= F250), K251 (= K253)
3h81A Crystal structure of enoyl-coa hydratase from mycobacterium tuberculosis (see paper)
35% identity, 99% coverage: 3:261/261 of query aligns to 3:256/256 of 3h81A
- active site: A64 (≠ Q63), M69 (≠ R68), T79 (≠ D84), F83 (≠ N88), G107 (≠ A112), E110 (≠ N115), P129 (≠ S134), E130 (≠ F135), V135 (≠ L140), P137 (= P142), G138 (≠ D143), L223 (≠ D228), F233 (≠ G238)
- binding calcium ion: F233 (≠ G238), Q238 (≠ Y243)
3q0gD Crystal structure of the mycobacterium tuberculosis crotonase bound to a reaction intermediate derived from crotonyl coa
35% identity, 98% coverage: 3:258/261 of query aligns to 3:249/250 of 3q0gD
- active site: A64 (≠ Q63), M69 (≠ R68), T75 (≠ D84), F79 (≠ N88), G103 (≠ A112), E106 (≠ N115), P125 (≠ S134), E126 (≠ F135), V131 (≠ L140), P133 (= P142), G134 (≠ D143), L219 (≠ D228), F229 (≠ G238)
- binding Butyryl Coenzyme A: F225 (≠ Q234), F241 (= F250)
3q0jC Crystal structure of the mycobacterium tuberculosis crotonase in complex with the inhibitor acetoacetylcoa
35% identity, 98% coverage: 3:258/261 of query aligns to 4:254/255 of 3q0jC
- active site: A65 (≠ Q63), M70 (≠ R68), T80 (≠ D84), F84 (≠ N88), G108 (≠ A112), E111 (≠ N115), P130 (≠ S134), E131 (≠ F135), V136 (≠ L140), P138 (= P142), G139 (≠ D143), L224 (≠ D228), F234 (≠ G238)
- binding acetoacetyl-coenzyme a: Q23 (≠ G22), A24 (≠ R23), L25 (≠ I24), A27 (= A26), A63 (= A61), G64 (= G62), A65 (≠ Q63), D66 (= D64), I67 (≠ L65), K68 (≠ S66), M70 (≠ R68), F84 (≠ N88), G107 (= G111), G108 (≠ A112), E111 (≠ N115), P130 (≠ S134), E131 (≠ F135), P138 (= P142), G139 (≠ D143), M140 (≠ S144)
3q0gC Crystal structure of the mycobacterium tuberculosis crotonase bound to a reaction intermediate derived from crotonyl coa
35% identity, 98% coverage: 3:258/261 of query aligns to 4:254/255 of 3q0gC
- active site: A65 (≠ Q63), M70 (≠ R68), T80 (≠ D84), F84 (≠ N88), G108 (≠ A112), E111 (≠ N115), P130 (≠ S134), E131 (≠ F135), V136 (≠ L140), P138 (= P142), G139 (≠ D143), L224 (≠ D228), F234 (≠ G238)
- binding coenzyme a: L25 (≠ I24), A63 (= A61), I67 (≠ L65), K68 (≠ S66), Y104 (≠ T108), P130 (≠ S134), E131 (≠ F135), L134 (≠ V138)
5dufA Crystal structure of m. Tuberculosis echa6 bound to ligand gsk729a (see paper)
37% identity, 99% coverage: 2:260/261 of query aligns to 1:244/245 of 5dufA
- active site: A62 (≠ Q63), D67 (= D74), P74 (≠ D84), I78 (≠ N88), A102 (= A112), Q105 (≠ N115), P124 (≠ S134), T125 (≠ F135), L130 (= L140), L132 (≠ P142), D133 (= D143), P212 (≠ D228), W222 (≠ G238)
- binding (5R,7S)-5-(4-ethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylic acid: L77 (≠ Y87), I78 (≠ N88), H81 (≠ I91), D85 (≠ K95), Q105 (≠ N115), D133 (= D143), W135 (≠ G145)
5ducA Crystal structure of m. Tuberculosis echa6 bound to ligand gsk951a (see paper)
38% identity, 95% coverage: 13:260/261 of query aligns to 11:243/244 of 5ducA
- active site: A61 (≠ Q63), D66 (= D74), P73 (≠ D84), I77 (≠ N88), A101 (= A112), Q104 (≠ N115), P123 (≠ S134), T124 (≠ F135), L129 (= L140), L131 (≠ P142), D132 (= D143), P211 (≠ D228), W221 (≠ G238)
- binding (5R,7S)-N-(1,3-benzodioxol-5-ylmethyl)-5-(4-ethylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide: L76 (≠ Y87), H80 (≠ I91), D84 (≠ K95), Q104 (≠ N115), D132 (= D143), W134 (≠ G145), F217 (≠ Q234)
5du4A Crystal structure of m. Tuberculosis echa6 bound to ligand gsk366a (see paper)
38% identity, 95% coverage: 13:260/261 of query aligns to 11:243/244 of 5du4A
- active site: A61 (≠ Q63), D66 (= D74), P73 (≠ D84), I77 (≠ N88), A101 (= A112), Q104 (≠ N115), P123 (≠ S134), T124 (≠ F135), L129 (= L140), L131 (≠ P142), D132 (= D143), P211 (≠ D228), W221 (≠ G238)
- binding (5R,7S)-5-(4-ethylphenyl)-N-(4-methoxybenzyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide: L76 (≠ Y87), I77 (≠ N88), H80 (≠ I91), D84 (≠ K95), Q104 (≠ N115), D132 (= D143), W134 (≠ G145)
5dtwA Crystal structure of m. Tuberculosis echa6 bound to c20-coa (see paper)
38% identity, 95% coverage: 13:260/261 of query aligns to 11:243/244 of 5dtwA
- active site: A61 (≠ Q63), D66 (= D74), P73 (≠ D84), I77 (≠ N88), A101 (= A112), Q104 (≠ N115), P123 (≠ S134), T124 (≠ F135), L129 (= L140), L131 (≠ P142), D132 (= D143), P211 (≠ D228), W221 (≠ G238)
- binding Arachinoyl-CoA: R18 (= R20), E20 (≠ G22), R21 (= R23), R21 (= R23), R22 (≠ I24), A24 (= A26), A59 (= A61), A61 (≠ Q63), D62 (= D64), L63 (= L65), H80 (≠ I91), D84 (≠ K95), G100 (= G111), A101 (= A112), Y127 (≠ V138), W134 (≠ G145)
5du6A Crystal structure of m. Tuberculosis echa6 bound to ligand gsk059a. (see paper)
37% identity, 95% coverage: 13:260/261 of query aligns to 11:241/242 of 5du6A
- active site: A61 (≠ Q63), P71 (≠ D84), I75 (≠ N88), A99 (= A112), Q102 (≠ N115), P121 (≠ S134), T122 (≠ F135), L127 (= L140), L129 (≠ P142), D130 (= D143), P209 (≠ D228), W219 (≠ G238)
- binding (5R,7R)-5-(4-ethylphenyl)-N-(4-fluorobenzyl)-7-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide: L74 (≠ Y87), D82 (≠ K95), D130 (= D143), W132 (≠ G145), A207 (≠ Q226), K212 (≠ R231), F215 (≠ Q234)
5du8A Crystal structure of m. Tuberculosis echa6 bound to gsk572a (see paper)
37% identity, 95% coverage: 13:260/261 of query aligns to 11:233/234 of 5du8A
- active site: A61 (≠ Q63), P63 (= P77), I67 (≠ N88), A91 (= A112), Q94 (≠ N115), P113 (≠ S134), T114 (≠ F135), L119 (= L140), L121 (≠ P142), D122 (= D143), P201 (≠ D228), W211 (≠ G238)
- binding (5R,7S)-5-(4-ethylphenyl)-N-[(5-fluoropyridin-2-yl)methyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide: L66 (≠ Y87), I67 (≠ N88), H70 (≠ I91), Q94 (≠ N115), D122 (= D143), W124 (≠ G145), F207 (≠ Q234)
5jbxB Crystal structure of liuc in complex with coenzyme a and malonic acid (see paper)
36% identity, 96% coverage: 11:261/261 of query aligns to 13:261/261 of 5jbxB
- active site: A67 (≠ Q63), R72 (= R68), L84 (= L83), R88 (≠ I91), G112 (≠ A112), E115 (≠ N115), T134 (≠ S134), E135 (≠ F135), I140 (≠ L140), P142 (= P142), G143 (≠ D143), A228 (≠ D228), L238 (≠ G238)
- binding coenzyme a: S24 (≠ G22), R25 (= R23), R26 (≠ I24), A28 (= A26), A65 (= A61), D68 (= D64), L69 (= L65), K70 (≠ S66), L110 (≠ A110), G111 (= G111), T134 (≠ S134), E135 (≠ F135), L138 (≠ V138), R168 (≠ K168)
2hw5C The crystal structure of human enoyl-coenzyme a (coa) hydratase short chain 1, echs1
31% identity, 98% coverage: 3:259/261 of query aligns to 4:258/260 of 2hw5C
- active site: A68 (≠ Q63), M73 (≠ R68), S83 (≠ D84), L87 (≠ N88), G111 (≠ A112), E114 (≠ N115), P133 (≠ S134), E134 (≠ F135), T139 (≠ L140), P141 (= P142), G142 (≠ D143), K227 (≠ D228), F237 (≠ G238)
- binding crotonyl coenzyme a: K26 (≠ G22), A27 (≠ R23), L28 (≠ I24), A30 (= A26), K62 (= K57), I70 (≠ L65), F109 (≠ A110)
O53561 Enoyl-CoA hydratase EchA19; EC 4.2.1.- from Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) (see 2 papers)
33% identity, 98% coverage: 6:261/261 of query aligns to 11:266/266 of O53561