7OFF
Keap1 kelch domain bound to a small molecule inhibitor of the Keap1-Nrf2 protein-protein interaction
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 9 |
| Details | binding site for residue SO4 A 701 |
| Chain | Residue |
| A | ILE435 |
| A | HIS437 |
| A | SER438 |
| A | SER439 |
| A | ARG494 |
| A | HOH801 |
| A | HOH802 |
| A | HOH854 |
| A | HOH897 |
| site_id | AC2 |
| Number of Residues | 6 |
| Details | binding site for residue SO4 A 702 |
| Chain | Residue |
| A | CYS434 |
| A | HIS436 |
| A | ARG459 |
| A | ARG494 |
| A | ARG498 |
| A | HOH840 |
| site_id | AC3 |
| Number of Residues | 2 |
| Details | binding site for residue DMS A 703 |
| Chain | Residue |
| A | HIS451 |
| A | LEU452 |
| site_id | AC4 |
| Number of Residues | 2 |
| Details | binding site for residue DMS A 704 |
| Chain | Residue |
| A | ARG494 |
| A | ASN495 |
| site_id | AC5 |
| Number of Residues | 3 |
| Details | binding site for residue DMS A 705 |
| Chain | Residue |
| A | MET456 |
| A | LEU457 |
| A | ARG459 |
| site_id | AC6 |
| Number of Residues | 6 |
| Details | binding site for residue DMS A 706 |
| Chain | Residue |
| A | THR388 |
| A | ASP389 |
| A | SER390 |
| A | SER391 |
| A | ARG470 |
| A | HOH865 |
| site_id | AC7 |
| Number of Residues | 2 |
| Details | binding site for residue DMS A 707 |
| Chain | Residue |
| A | HIS424 |
| A | ARG442 |
| site_id | AC8 |
| Number of Residues | 2 |
| Details | binding site for residue DMS A 708 |
| Chain | Residue |
| A | PRO361 |
| A | HIS553 |
| site_id | AC9 |
| Number of Residues | 4 |
| Details | binding site for residue DMS A 709 |
| Chain | Residue |
| A | LEU452 |
| A | VAL453 |
| A | ALA454 |
| A | ASN495 |
| site_id | AD1 |
| Number of Residues | 4 |
| Details | binding site for residue DMS A 710 |
| Chain | Residue |
| A | TYR334 |
| A | SER602 |
| A | GLY603 |
| A | DMS711 |
| site_id | AD2 |
| Number of Residues | 6 |
| Details | binding site for residue DMS A 711 |
| Chain | Residue |
| A | ARG380 |
| A | ASN382 |
| A | ASN414 |
| A | ARG415 |
| A | DMS710 |
| A | HOH818 |
| site_id | AD3 |
| Number of Residues | 10 |
| Details | binding site for residue VCB A 712 |
| Chain | Residue |
| A | ARG415 |
| A | ARG483 |
| A | SER508 |
| A | GLY509 |
| A | TYR525 |
| A | GLN530 |
| A | SER555 |
| A | TYR572 |
| A | PHE577 |
| A | SER602 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 45 |
| Details | Repeat: {"description":"Kelch 1"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 50 |
| Details | Repeat: {"description":"Kelch 2"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 46 |
| Details | Repeat: {"description":"Kelch 3"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 46 |
| Details | Repeat: {"description":"Kelch 4"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI5 |
| Number of Residues | 45 |
| Details | Repeat: {"description":"Kelch 5"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI6 |
| Number of Residues | 46 |
| Details | Repeat: {"description":"Kelch 6"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI7 |
| Number of Residues | 1 |
| Details | Site: {"description":"Sensor for electrophilic agents","evidences":[{"source":"PubMed","id":"20498371","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI8 |
| Number of Residues | 1 |
| Details | Modified residue: {"description":"S-cGMP-cysteine","evidences":[{"source":"PubMed","id":"20498371","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI9 |
| Number of Residues | 1 |
| Details | Modified residue: {"description":"S-(2-succinyl)cysteine","evidences":[{"source":"PubMed","id":"22014577","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
