6UOX
Structure of itraconazole-bound NPC1
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | NPC intracellular cholesterol transporter 1 | polymer | 1286 | 143315.0 | 1 | UniProt (O15118) Pfam (PF16414) Pfam (PF22314) Pfam (PF12349) Pfam (PF02460) | Homo sapiens (Human) | Niemann-Pick C1 protein |
| 2 | B (B) | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 424.4 | 1 | In PDB GlyTouCan (G42666HT) | |||
| 3 | C (C) | alpha-D-mannopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 586.5 | 1 | In PDB GlyTouCan (G66019PC) | |||
| 4 | D, E, F, G, H... (A) | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 8 | Chemie (NAG) | |||
| 5 | L (A) | 4-(3-bromo-4-{4-[4-({(2R,4S)-2-(2,4-dichlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolan-4-yl}methoxy)phenyl]piperazin-1-yl}phenyl)-2-[(2S)-butan-2-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one | non-polymer | 784.5 | 1 | Chemie (QDG) |
Sequence modifications
A: 1 - 1278 (UniProt: O15118)
| PDB | External Database | Details |
|---|---|---|
| Trp 1279 | - | expression tag |
| Ser 1280 | - | expression tag |
| His 1281 | - | expression tag |
| Pro 1282 | - | expression tag |
| Gln 1283 | - | expression tag |
| Phe 1284 | - | expression tag |
| Glu 1285 | - | expression tag |
| Lys 1286 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 143315.0 | |
| Branched | Number of molecules | 2 |
| Total formula weight | 1010.9 | |
| Non-Polymers* | Number of molecules | 9 |
| Total formula weight | 2554.2 | |
| All* | Total formula weight | 146880.2 |
