4KQX
Mutant Slackia exigua KARI DDV in complex with NAD and an inhibitor
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0000287 | molecular_function | magnesium ion binding |
| A | 0004455 | molecular_function | ketol-acid reductoisomerase activity |
| A | 0005829 | cellular_component | cytosol |
| A | 0008652 | biological_process | amino acid biosynthetic process |
| A | 0009082 | biological_process | branched-chain amino acid biosynthetic process |
| A | 0009097 | biological_process | isoleucine biosynthetic process |
| A | 0009099 | biological_process | L-valine biosynthetic process |
| A | 0016491 | molecular_function | oxidoreductase activity |
| A | 0046872 | molecular_function | metal ion binding |
| A | 0050661 | molecular_function | NADP binding |
| B | 0000287 | molecular_function | magnesium ion binding |
| B | 0004455 | molecular_function | ketol-acid reductoisomerase activity |
| B | 0005829 | cellular_component | cytosol |
| B | 0008652 | biological_process | amino acid biosynthetic process |
| B | 0009082 | biological_process | branched-chain amino acid biosynthetic process |
| B | 0009097 | biological_process | isoleucine biosynthetic process |
| B | 0009099 | biological_process | L-valine biosynthetic process |
| B | 0016491 | molecular_function | oxidoreductase activity |
| B | 0046872 | molecular_function | metal ion binding |
| B | 0050661 | molecular_function | NADP binding |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 33 |
| Details | BINDING SITE FOR RESIDUE NAD A 401 |
| Chain | Residue |
| A | GLY34 |
| A | PRO92 |
| A | ASP93 |
| A | VAL95 |
| A | GLN96 |
| A | VAL99 |
| A | ALA117 |
| A | HIS118 |
| A | PRO140 |
| A | PRO143 |
| A | GLY144 |
| A | TYR35 |
| A | HOH515 |
| A | HOH527 |
| A | HOH541 |
| A | HOH559 |
| A | HOH565 |
| A | HOH610 |
| A | HOH616 |
| B | SER260 |
| B | ILE261 |
| B | SER262 |
| A | GLY36 |
| B | HIO401 |
| B | MG406 |
| B | HOH633 |
| B | HOH639 |
| A | SER37 |
| A | GLN38 |
| A | ARG58 |
| A | ASP61 |
| A | LEU90 |
| A | VAL91 |
| site_id | AC2 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE HIO A 402 |
| Chain | Residue |
| A | GLU241 |
| A | ILE261 |
| A | SER262 |
| A | ALA265 |
| B | PRO143 |
| B | ASP201 |
| B | GLU205 |
| B | CYS210 |
| B | NAD402 |
| B | MG407 |
| B | MG409 |
| B | HOH514 |
| B | HOH516 |
| B | HOH632 |
| site_id | AC3 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE MG A 403 |
| Chain | Residue |
| A | ASN258 |
| A | ILE261 |
| A | SER262 |
| A | ASN263 |
| A | GLU266 |
| site_id | AC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE MG A 404 |
| Chain | Residue |
| A | TYR259 |
| A | SER260 |
| A | ILE261 |
| A | HOH595 |
| B | NAD402 |
| site_id | AC5 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG A 405 |
| Chain | Residue |
| A | ASP201 |
| A | MG406 |
| A | HOH602 |
| B | HIO401 |
| B | HOH628 |
| B | HOH634 |
| site_id | AC6 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG A 406 |
| Chain | Residue |
| A | ASP201 |
| A | GLU205 |
| A | MG405 |
| A | HOH605 |
| B | HIO401 |
| B | HOH633 |
| site_id | AC7 |
| Number of Residues | 16 |
| Details | BINDING SITE FOR RESIDUE HIO B 401 |
| Chain | Residue |
| A | PRO143 |
| A | ASP201 |
| A | GLU205 |
| A | CYS210 |
| A | NAD401 |
| A | MG405 |
| A | MG406 |
| A | HOH602 |
| A | HOH605 |
| B | GLU241 |
| B | ILE261 |
| B | SER262 |
| B | ALA265 |
| B | HOH628 |
| B | HOH633 |
| B | HOH634 |
| site_id | AC8 |
| Number of Residues | 31 |
| Details | BINDING SITE FOR RESIDUE NAD B 402 |
| Chain | Residue |
| B | ASP93 |
| B | GLN96 |
| B | VAL99 |
| B | ALA117 |
| B | HIS118 |
| B | PRO140 |
| B | GLY142 |
| B | PRO143 |
| B | GLY144 |
| B | MG408 |
| B | HOH508 |
| B | HOH514 |
| B | HOH516 |
| B | HOH557 |
| B | HOH560 |
| B | HOH583 |
| B | HOH641 |
| A | SER260 |
| A | ILE261 |
| A | SER262 |
| A | HIO402 |
| A | MG404 |
| B | TYR35 |
| B | GLY36 |
| B | SER37 |
| B | GLN38 |
| B | ARG58 |
| B | ASP61 |
| B | LEU90 |
| B | VAL91 |
| B | PRO92 |
| site_id | AC9 |
| Number of Residues | 13 |
| Details | BINDING SITE FOR RESIDUE HIS B 403 |
| Chain | Residue |
| A | GLN280 |
| A | ALA284 |
| A | HOH560 |
| A | HOH561 |
| A | HOH601 |
| B | ASN278 |
| B | GLU341 |
| B | ASP342 |
| B | LEU343 |
| B | GLU344 |
| B | HOH548 |
| B | HOH597 |
| B | HOH646 |
| site_id | BC1 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE MG B 404 |
| Chain | Residue |
| B | ASN258 |
| B | ILE261 |
| B | SER262 |
| B | ASN263 |
| B | GLU266 |
| site_id | BC2 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG B 405 |
| Chain | Residue |
| B | ALA81 |
| B | GLU82 |
| B | ALA84 |
| B | HIS107 |
| B | ASN112 |
| B | HOH649 |
| site_id | BC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG B 406 |
| Chain | Residue |
| A | SER37 |
| A | NAD401 |
| B | TYR259 |
| B | SER260 |
| B | ILE261 |
| B | HOH639 |
| site_id | BC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE MG B 407 |
| Chain | Residue |
| A | HIO402 |
| A | HOH502 |
| A | HOH504 |
| B | ASP201 |
| B | HOH516 |
| site_id | BC5 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG B 408 |
| Chain | Residue |
| B | GLY36 |
| B | SER37 |
| B | GLN38 |
| B | GLY39 |
| B | LEU90 |
| B | NAD402 |
| site_id | BC6 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE MG B 409 |
| Chain | Residue |
| A | HIO402 |
| B | ASP201 |
| B | GLU205 |
| B | HOH514 |
| B | HOH632 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 2 |
| Details | Active site: {"evidences":[{"source":"HAMAP-Rule","id":"MF_00435","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 24 |
| Details | Binding site: {"evidences":[{"source":"HAMAP-Rule","id":"MF_00435","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"23776225","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 6 |
| Details | Binding site: {"evidences":[{"source":"HAMAP-Rule","id":"MF_00435","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 180 |
| Details | Domain: {"description":"KARI N-terminal Rossmann","evidences":[{"source":"PROSITE-ProRule","id":"PRU01197","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI5 |
| Number of Residues | 145 |
| Details | Domain: {"description":"KARI C-terminal knotted","evidences":[{"source":"PROSITE-ProRule","id":"PRU01198","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
