8HNN
Structure of CXCR3 complexed with antagonist SCH546738
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (N) | Nb6 | polymer | 169 | 18665.9 | 1 | Lama glama | ||
| 2 | B (R) | Soluble cytochrome b562,C-X-C chemokine receptor type 3,Kappa-type opioid receptor | polymer | 507 | 56327.1 | 1 | UniProt (P0ABE7) UniProt (P49682) UniProt (P41145) Pfam (PF07361) Pfam (PF00001) | Escherichia coli | Cytochrome b-562,CXC-R3,CXCR-3,CKR-L2,G protein-coupled receptor 9,Interferon-inducible protein 10 receptor,IP-10 receptor,K-OR-1,KOR-1 |
| 3 | C (R) | 3-azanyl-6-chloranyl-5-[(3S)-4-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-3-ethyl-piperazin-1-yl]pyrazine-2-carboxamide | non-polymer | 492.4 | 1 | Chemie (43I) | |||
| 4 | D (R) | CHOLESTEROL | non-polymer | 386.7 | 1 | Chemie (CLR) |
Sequence modifications
R: -111 - -7 (UniProt: P0ABE7)
R: 1 - 240 (UniProt: P49682)
R: 241 - 262 (UniProt: P41145)
R: 263 - 369 (UniProt: P49682)
| PDB | External Database | Details |
|---|---|---|
| Met -137 | - | initiating methionine |
| Lys -136 | - | expression tag |
| Thr -135 | - | expression tag |
| Ile -134 | - | expression tag |
| Ile -133 | - | expression tag |
| Ala -132 | - | expression tag |
| Leu -131 | - | expression tag |
| Ser -130 | - | expression tag |
| Tyr -129 | - | expression tag |
| Ile -128 | - | expression tag |
| Phe -127 | - | expression tag |
| Cys -126 | - | expression tag |
| Leu -125 | - | expression tag |
| Val -124 | - | expression tag |
| Phe -123 | - | expression tag |
| Ala -122 | - | expression tag |
| Asp -121 | - | expression tag |
| Tyr -120 | - | expression tag |
| Lys -119 | - | expression tag |
| Asp -118 | - | expression tag |
| Asp -117 | - | expression tag |
| Asp -116 | - | expression tag |
| Asp -115 | - | expression tag |
| Lys -114 | - | expression tag |
| Gly -113 | - | expression tag |
| Ser -112 | - | expression tag |
| Trp -105 | Met 29 | conflict |
| Ile -10 | His 124 | conflict |
| Leu -6 | - | linker |
| Leu -5 | - | linker |
| Val -4 | - | linker |
| Pro -3 | - | linker |
| Arg -2 | - | linker |
| Gly -1 | - | linker |
| Ser 0 | - | linker |
R: 241 - 262 (UniProt: P41145)
R: 263 - 369 (UniProt: P49682)
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 74993.0 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 879.1 | |
| All* | Total formula weight | 75872.1 |
