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 | C-C chemokine receptor type 9 | polymer | 331 | 37877.9 | 2 | UniProt (P51686) Pfam (PF00001) In PDB | Homo sapiens (Human) | CCR-9,G-protein coupled receptor 28,GPR-9-6 |
2 | A, B | Vercirnon | non-polymer | 444.9 | 2 | Chemie (79K) | |||
3 | B, A | OLEIC ACID | non-polymer | 282.5 | 28 | Chemie (OLA) | |||
4 | A | CHOLESTEROL | non-polymer | 386.7 | 1 | Chemie (CLR) | |||
5 | B, A | MALONATE ION | non-polymer | 102.0 | 2 | Chemie (MLI) | |||
6 | 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 |