5OIF
InhA (T2A mutant) complexed with 1-benzyl-3-methyl-1H-pyrazol-5-amine
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0004318 | molecular_function | enoyl-[acyl-carrier-protein] reductase (NADH) activity |
A | 0005504 | molecular_function | fatty acid binding |
A | 0005886 | cellular_component | plasma membrane |
A | 0006633 | biological_process | fatty acid biosynthetic process |
A | 0009274 | cellular_component | peptidoglycan-based cell wall |
A | 0016491 | molecular_function | oxidoreductase activity |
A | 0030497 | biological_process | fatty acid elongation |
A | 0046677 | biological_process | response to antibiotic |
A | 0050343 | molecular_function | trans-2-enoyl-CoA reductase (NADH) activity |
A | 0070403 | molecular_function | NAD+ binding |
A | 0071768 | biological_process | mycolic acid biosynthetic process |
B | 0004318 | molecular_function | enoyl-[acyl-carrier-protein] reductase (NADH) activity |
B | 0005504 | molecular_function | fatty acid binding |
B | 0005886 | cellular_component | plasma membrane |
B | 0006633 | biological_process | fatty acid biosynthetic process |
B | 0009274 | cellular_component | peptidoglycan-based cell wall |
B | 0016491 | molecular_function | oxidoreductase activity |
B | 0030497 | biological_process | fatty acid elongation |
B | 0046677 | biological_process | response to antibiotic |
B | 0050343 | molecular_function | trans-2-enoyl-CoA reductase (NADH) activity |
B | 0070403 | molecular_function | NAD+ binding |
B | 0071768 | biological_process | mycolic acid biosynthetic process |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 33 |
Details | binding site for residue NAD A 301 |
Chain | Residue |
A | GLY14 |
A | SER94 |
A | ILE95 |
A | GLY96 |
A | ILE122 |
A | MET147 |
A | ASP148 |
A | PHE149 |
A | LYS165 |
A | PRO193 |
A | ILE194 |
A | ILE15 |
A | MET199 |
A | 9W5302 |
A | HOH416 |
A | HOH422 |
A | HOH423 |
A | HOH427 |
A | HOH428 |
A | HOH435 |
A | HOH438 |
A | HOH488 |
A | ILE16 |
A | HOH493 |
A | HOH494 |
A | HOH500 |
A | HOH501 |
A | SER20 |
A | ILE21 |
A | PHE41 |
A | LEU63 |
A | ASP64 |
A | VAL65 |
site_id | AC2 |
Number of Residues | 5 |
Details | binding site for residue 9W5 A 302 |
Chain | Residue |
A | GLY96 |
A | MET98 |
A | MET161 |
A | NAD301 |
A | HOH422 |
site_id | AC3 |
Number of Residues | 30 |
Details | binding site for residue NAD B 301 |
Chain | Residue |
B | GLY14 |
B | ILE15 |
B | ILE16 |
B | SER20 |
B | ILE21 |
B | PHE41 |
B | LEU63 |
B | ASP64 |
B | VAL65 |
B | SER94 |
B | ILE95 |
B | GLY96 |
B | ILE122 |
B | MET147 |
B | ASP148 |
B | PHE149 |
B | LYS165 |
B | PRO193 |
B | ILE194 |
B | 9W5302 |
B | HOH413 |
B | HOH417 |
B | HOH427 |
B | HOH432 |
B | HOH435 |
B | HOH456 |
B | HOH459 |
B | HOH481 |
B | HOH493 |
B | HOH494 |
site_id | AC4 |
Number of Residues | 5 |
Details | binding site for residue 9W5 B 302 |
Chain | Residue |
B | GLY96 |
B | MET103 |
B | PHE149 |
B | MET161 |
B | NAD301 |
Functional Information from SwissProt/UniProt
site_id | SWS_FT_FI1 |
Number of Residues | 10 |
Details | BINDING: BINDING => ECO:0000269|PubMed:10336454, ECO:0000269|PubMed:16647717, ECO:0000269|PubMed:7886450, ECO:0007744|PDB:1BVR, ECO:0007744|PDB:1ENY, ECO:0007744|PDB:2AQ8 |
Chain | Residue | Details |
B | ASP64 | |
B | ILE95 | |
B | LYS165 | |
B | ILE194 | |
A | SER20 | |
A | ASP64 | |
A | ILE95 | |
A | LYS165 | |
A | ILE194 | |
B | SER20 |
site_id | SWS_FT_FI2 |
Number of Residues | 2 |
Details | BINDING: BINDING => ECO:0000269|PubMed:10336454 |
Chain | Residue | Details |
A | TYR158 | |
B | TYR158 |
site_id | SWS_FT_FI3 |
Number of Residues | 2 |
Details | SITE: May act as an intermediate that passes the hydride ion from NADH to the substrate => ECO:0000305|PubMed:10336454 |
Chain | Residue | Details |
A | PHE149 | |
B | PHE149 |
site_id | SWS_FT_FI4 |
Number of Residues | 2 |
Details | SITE: Transition state stabilizer => ECO:0000305|PubMed:10521269 |
Chain | Residue | Details |
A | TYR158 | |
B | TYR158 |
site_id | SWS_FT_FI5 |
Number of Residues | 2 |
Details | MOD_RES: Phosphothreonine => ECO:0000269|PubMed:20864541, ECO:0000269|PubMed:21143326 |
Chain | Residue | Details |
A | THR266 | |
B | THR266 |