5LWE
Crystal structure of the human CC chemokine receptor type 9 (CCR9) in complex with vercirnon
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | C-C chemokine receptor type 9 | polymer | 331 | 37877.9 | 2 | UniProt (P51686) Pfam (PF00001) | Homo sapiens (Human) | CCR-9,G-protein coupled receptor 28,GPR-9-6 |
| 2 | C, U (A, B) | Vercirnon | non-polymer | 444.9 | 2 | Chemie (79K) PubChem (10343454) | |||
| 3 | AA, BA, CA, D, DA... (B, A) | OLEIC ACID | non-polymer | 282.5 | 28 | Chemie (OLA) PubChem (965) PubChem (445639) PubChem (637517) | |||
| 4 | S (A) | CHOLESTEROL | non-polymer | 386.7 | 1 | Chemie (CLR) PubChem (16219173) PubChem (16758052) PubChem (304) PubChem (176980071) PubChem (40477506) PubChem (40557614) PubChem (42579431) PubChem (42579432) PubChem (18640088) PubChem (1715243) PubChem (1715244) PubChem (45044259) PubChem (23423981) PubChem (49853509) PubChem (50990013) PubChem (52934537) PubChem (56621683) PubChem (191463) PubChem (57915018) PubChem (57939063) PubChem (58428240) PubChem (58445498) PubChem (58663286) PubChem (368063) PubChem (369319) PubChem (44654663) PubChem (59450329) PubChem (59628412) PubChem (59965215) PubChem (71234641) PubChem (59993755) PubChem (60001463) PubChem (66634651) PubChem (68055877) PubChem (68166463) PubChem (68315613) PubChem (46937002) PubChem (70795838) PubChem (70797612) PubChem (70954610) PubChem (70957185) PubChem (71463909) PubChem (638019) PubChem (59274407) PubChem (1549081) PubChem (1553803) PubChem (68311425) PubChem (68311398) PubChem (143173313) PubChem (177156123) PubChem (89951918) PubChem (90224410) PubChem (5997) PubChem (5283629) PubChem (5284644) PubChem (1551269) PubChem (90070115) PubChem (91298236) PubChem (5315842) PubChem (117965027) PubChem (6432564) PubChem (6710666) PubChem (124146240) PubChem (7059399) PubChem (124897607) PubChem (124896959) PubChem (6419195) PubChem (10861996) PubChem (132837164) PubChem (101624109) PubChem (6994560) PubChem (7055705) PubChem (7055706) PubChem (7059398) PubChem (7059400) PubChem (7059635) PubChem (7103033) PubChem (7182477) PubChem (7182478) PubChem (11834483) PubChem (11888915) PubChem (11888914) PubChem (9909206) PubChem (10045721) PubChem (71168115) PubChem (10134774) PubChem (10293553) PubChem (71173031) PubChem (124225449) PubChem (138967089) PubChem (11003580) PubChem (11025495) PubChem (11058155) PubChem (139566851) PubChem (124429284) PubChem (11463329) PubChem (11868624) PubChem (11868625) PubChem (11869366) PubChem (11869367) PubChem (11869368) PubChem (11869369) PubChem (12120344) PubChem (12156156) PubChem (12303135) PubChem (12303148) PubChem (12303156) PubChem (12303159) PubChem (12303160) PubChem (15939944) PubChem (124909223) PubChem (124909224) PubChem (124909225) PubChem (171828367) PubChem (173516975) PubChem (130459183) PubChem (131992107) PubChem (139568882) PubChem (142983773) PubChem (144054483) PubChem (144209461) PubChem (144331236) PubChem (144808354) PubChem (145053568) PubChem (145157652) PubChem (145215073) PubChem (145230478) PubChem (146320991) PubChem (147857230) PubChem (154993519) PubChem (158603858) PubChem (162906452) PubChem (162906453) PubChem (162906454) PubChem (162906455) PubChem (162906456) PubChem (162906457) PubChem (163255768) PubChem (163389210) PubChem (164665303) PubChem (166553771) PubChem (166712004) PubChem (170116175) PubChem (171764280) PubChem (171817101) PubChem (171817104) PubChem (174285573) | |||
| 5 | IA, T (B, A) | MALONATE ION | non-polymer | 102.0 | 2 | Chemie (MLI) PubChem (9084) | |||
| 6 | JA, KA (A, B) | water | water | 18.0 | 52 | Chemie (HOH) |
Sequence modifications
A, B: 23 - 341 (UniProt: P51686)
| PDB | External Database | Details |
|---|---|---|
| Ala 23 | Ser 23 | conflict |
| Glu 34 | Thr 34 | conflict |
| Ala 77 | Thr 77 | conflict |
| Ala 79 | Val 79 | conflict |
| Ala 82 | Met 82 | conflict |
| Cys 141 | Ser 141 | conflict |
| Ala 216 | Thr 216 | conflict |
| Ala 255 | Val 255 | conflict |
| Ala 294 | Asn 294 | conflict |
| Ala 304 | Thr 304 | conflict |
| Ala 337 | Cys 337 | conflict |
| Ala 342 | - | expression tag |
| Ala 343 | - | expression tag |
| His 344 | - | expression tag |
| His 345 | - | expression tag |
| His 346 | - | expression tag |
| His 347 | - | expression tag |
| His 348 | - | expression tag |
| His 349 | - | expression tag |
| His 350 | - | expression tag |
| His 351 | - | expression tag |
| His 352 | - | expression tag |
| His 353 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 75755.8 | |
| Non-Polymers* | Number of molecules | 33 |
| Total formula weight | 9389.5 | |
| All* | Total formula weight | 85145.3 |
