4MBS
Crystal Structure of the CCR5 Chemokine Receptor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B | Chimera protein of C-C chemokine receptor type 5 and Rubredoxin | polymer | 414 | 47516.3 | 2 | UniProt (P51681) UniProt (P00268) Pfam (PF00001) Pfam (PF00301) In PDB | Homo sapiens | C-C CKR-5, CC-CKR-5, CCR-5, CCR5, CHEMR13, HIV-1 fusion coreceptor |
| 2 | A, B | 4,4-difluoro-N-[(1S)-3-{(3-exo)-3-[3-methyl-5-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]oct-8-yl}-1-phenylpropyl]cyclohexanecarboxamide | non-polymer | 513.7 | 2 | Chemie (MRV) | |||
| 3 | A, B | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 4 | A, B | (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate | non-polymer | 356.5 | 10 | Chemie (OLC) | |||
| 5 | water | water | 18.0 | 48 | Chemie (HOH) |
Sequence modifications
A, B: 2 - 223 (UniProt: P51681)
A, B: 1001 - 1054 (UniProt: P00268)
A, B: 227 - 352 (UniProt: P51681)
| PDB | External Database | Details |
|---|---|---|
| Gly -1 | - | expression tag |
| Ala 0 | - | expression tag |
| Pro 1 | - | expression tag |
| Tyr 58 | Cys 58 | engineered mutation |
| Asn 163 | Gly 163 | engineered mutation |
A, B: 227 - 352 (UniProt: P51681)
| PDB | External Database | Details |
|---|---|---|
| Asp 233 | Ala 233 | engineered mutation |
| Glu 303 | Lys 303 | engineered mutation |
| Gly 353 | - | expression tag |
| Arg 354 | - | expression tag |
| Pro 355 | - | expression tag |
| Leu 356 | - | expression tag |
| Glu 357 | - | expression tag |
| Val 358 | - | expression tag |
| Leu 359 | - | expression tag |
| Phe 360 | - | expression tag |
| Gln 361 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 95032.6 | |
| Non-Polymers* | Number of molecules | 14 |
| Total formula weight | 4723.6 | |
| All* | Total formula weight | 99756.1 |
