7K5M
CRYSTAL STRUCTURE OF HBV CAPSID Y132A MUTANT IN COMPLEX WITH N-(3-chloro-4-fluorophenyl)-3-phenyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxamide AT 2.65A RESOLUTION
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, D, E... (A, B, C, D, E...) | Capsid protein | polymer | 158 | 17816.3 | 6 | UniProt (P03147) Pfam (PF00906) | Hepatitis B virus genotype D subtype adw (isolate United Kingdom/adyw/1979) (HBV-D) | Core antigen,Core protein,HBcAg,p21.5 |
| 2 | G, I, K, L, N... (A, B, C, D, E...) | N-(3-chloro-4-fluorophenyl)-3-phenyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxamide | non-polymer | 370.8 | 6 | Chemie (VXJ) | |||
| 3 | H, J, M, O, P (A, B, D, E) | ISOPROPYL ALCOHOL | non-polymer | 60.1 | 5 | Chemie (IPA) | |||
| 4 | R, S (C, E) | water | water | 18.0 | 3 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F: 1 - 149 (UniProt: P03147)
| PDB | External Database | Details |
|---|---|---|
| Ser 0 | - | expression tag |
| Ala 132 | Tyr 132 | engineered mutation |
| Lys 150 | - | expression tag |
| Leu 151 | - | expression tag |
| Glu 152 | - | expression tag |
| Asn 153 | - | expression tag |
| Leu 154 | - | expression tag |
| Tyr 155 | - | expression tag |
| Phe 156 | - | expression tag |
| Gln 157 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 6 |
| Total formula weight | 106898.0 | |
| Non-Polymers* | Number of molecules | 11 |
| Total formula weight | 2525.3 | |
| All* | Total formula weight | 109423.3 |
