5WDY
Crystal structure of WNK1 in complex with 1-cyclohexyl-N-({6-fluoro-1-[2-(3-methoxyphenyl)pyridin-4-yl]-1H-indol-3-yl}methyl)methanamine (compound 6)
Functional Information from GO Data
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 9 |
| Details | binding site for residue ANP A 901 |
| Chain | Residue |
| A | GLY228 |
| A | GLY230 |
| A | SER231 |
| A | LYS233 |
| A | VAL235 |
| A | GLU302 |
| A | MET304 |
| A | LYS351 |
| A | MN904 |
| site_id | AC2 |
| Number of Residues | 11 |
| Details | binding site for residue A6S A 902 |
| Chain | Residue |
| A | PHE265 |
| A | GLU268 |
| A | ALA269 |
| A | LEU272 |
| A | VAL281 |
| A | PHE283 |
| A | LEU299 |
| A | ASP368 |
| A | LEU369 |
| A | GLY370 |
| A | ALA372 |
| site_id | AC3 |
| Number of Residues | 1 |
| Details | binding site for residue MN A 903 |
| Chain | Residue |
| A | HOH1007 |
| site_id | AC4 |
| Number of Residues | 4 |
| Details | binding site for residue MN A 904 |
| Chain | Residue |
| A | ASN354 |
| A | ASP368 |
| A | ANP901 |
| A | HOH1005 |
| site_id | AC5 |
| Number of Residues | 3 |
| Details | binding site for residue MN B 501 |
| Chain | Residue |
| B | ASN354 |
| B | ASP368 |
| B | ANP502 |
| site_id | AC6 |
| Number of Residues | 8 |
| Details | binding site for residue ANP B 502 |
| Chain | Residue |
| B | GLY230 |
| B | LYS233 |
| B | VAL235 |
| B | GLU302 |
| B | LEU303 |
| B | MET304 |
| B | ASP368 |
| B | MN501 |
| site_id | AC7 |
| Number of Residues | 12 |
| Details | binding site for residue A6S B 503 |
| Chain | Residue |
| B | PHE265 |
| B | GLU268 |
| B | ALA269 |
| B | LEU272 |
| B | VAL281 |
| B | PHE283 |
| B | SER286 |
| B | ASP368 |
| B | LEU369 |
| B | GLY370 |
| B | ALA372 |
| B | LEU374 |
Functional Information from PROSITE/UniProt
| site_id | PS00108 |
| Number of Residues | 13 |
| Details | PROTEIN_KINASE_ST Serine/Threonine protein kinases active-site signature. IiHrDLKcdNIFI |
| Chain | Residue | Details |
| A | ILE345-ILE357 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 2 |
| Details | Active site: {"description":"Proton acceptor","evidences":[{"source":"PubMed","id":"16263722","evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 10 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"27712055","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"28771350","evidenceCode":"ECO:0000305"},{"source":"PDB","id":"5TF9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5WDY","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5WE8","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 8 |
| Details | Binding site: {"evidences":[{"source":"UniProtKB","id":"Q9JIH7","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
