5FUT
Human choline kinase a1 in complex with compound 4-(dimethylamino)-1-{4-[4-(4-{[4-(pyrrolidin- 1-yl)pyridinium-1-yl]methyl}phenyl)butyl]benzyl}pyridinium (compound BR25)
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO A 1458 |
| Chain | Residue |
| A | PRO100 |
| A | LYS239 |
| A | LYS244 |
| A | HOH2090 |
| A | HOH2211 |
| A | HOH2275 |
| site_id | AC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO A 1459 |
| Chain | Residue |
| A | ARG453 |
| A | LEU93 |
| A | PHE449 |
| A | HIS450 |
| site_id | AC3 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO A 1460 |
| Chain | Residue |
| A | LEU144 |
| A | GLN207 |
| A | PHE208 |
| A | ILE209 |
| A | ARG213 |
| site_id | AC4 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO A 1461 |
| Chain | Residue |
| A | TYR352 |
| A | ALA364 |
| A | ALA443 |
| A | ASP446 |
| A | ALA447 |
| A | HOH2271 |
| A | HOH2277 |
| site_id | AC5 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO A 1462 |
| Chain | Residue |
| A | ARG270 |
| A | ALA428 |
| A | PHE435 |
| A | TYR437 |
| A | MET438 |
| A | HOH2260 |
| A | HOH2265 |
| site_id | AC6 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO A 1463 |
| Chain | Residue |
| A | GLU218 |
| A | LEU221 |
| A | GLU319 |
| A | LYS325 |
| A | HOH2118 |
| site_id | AC7 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO A 1464 |
| Chain | Residue |
| A | ASN281 |
| A | LEU284 |
| A | LEU376 |
| A | SER380 |
| A | LYS402 |
| A | HOH2236 |
| A | HOH2241 |
| site_id | AC8 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO A 1465 |
| Chain | Residue |
| A | ARG339 |
| A | GLN387 |
| A | HOH2254 |
| site_id | AC9 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO A 1466 |
| Chain | Residue |
| A | MET177 |
| A | VAL178 |
| A | PHE200 |
| A | PRO201 |
| A | HOH2057 |
| site_id | BC1 |
| Number of Residues | 11 |
| Details | BINDING SITE FOR RESIDUE PQ7 A 1467 |
| Chain | Residue |
| A | ASN305 |
| A | ASP306 |
| A | GLN308 |
| A | TYR333 |
| A | TYR354 |
| A | TRP420 |
| A | TRP423 |
| A | ILE433 |
| A | PHE435 |
| A | TYR437 |
| A | TYR440 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 14 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"17007874","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"20299452","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"2CKP","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3G15","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 2 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"17007874","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"2CKQ","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 1 |
| Details | Binding site: {"evidences":[{"evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 1 |
| Details | Modified residue: {"description":"N6-acetyllysine","evidences":[{"source":"PubMed","id":"34077757","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI5 |
| Number of Residues | 1 |
| Details | Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"34077757","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
