8I71
Hepatitis B virus core protein Y132A mutant in complex with Linvencorvir (RG7907), a Hepatitis B Virus (HBV) Core Protein Allosteric Modulator (CpAM)
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 | 155 | 17486.9 | 6 | UniProt (P03147) Pfam (PF00906) | Hepatitis B virus subtype adyw | Core antigen,Core protein,HBcAg,p21.5 |
| 2 | AA, G, R, W, X (E, A, C, D) | CHLORIDE ION | non-polymer | 35.5 | 5 | Chemie (CL) | |||
| 3 | CA, DA, H, I, N... (F, A, B, C, D) | ISOPROPYL ALCOHOL | non-polymer | 60.1 | 9 | Chemie (IPA) | |||
| 4 | J, K, O, P (A, B) | GLYCEROL | non-polymer | 92.1 | 4 | Chemie (GOL) | |||
| 5 | BA, EA, L, Q, V... (E, F, A, B, C...) | 3-[(8~{a}~{S})-7-[[5-ethoxycarbonyl-4-(3-fluoranyl-2-methyl-phenyl)-2-(1,3-thiazol-2-yl)-1,4-dihydropyrimidin-6-yl]methyl]-3-oxidanylidene-5,6,8,8~{a}-tetrahydro-1~{H}-imidazo[1,5-a]pyrazin-2-yl]-2,2-dimethyl-propanoic acid | non-polymer | 598.7 | 6 | Chemie (OTI) | |||
| 6 | M (A) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 1 | Chemie (DMS) | |||
| 7 | FA, GA, HA, IA, JA... (A, B, C, D, E...) | water | water | 18.0 | 703 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F: 1 - 149 (UniProt: P03147)
| PDB | External Database | Details |
|---|---|---|
| Ala 132 | Tyr 132 | engineered mutation |
| Glu 150 | - | expression tag |
| Asn 151 | - | expression tag |
| Leu 152 | - | expression tag |
| Tyr 153 | - | expression tag |
| Phe 154 | - | expression tag |
| Gln 155 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 6 |
| Total formula weight | 104921.5 | |
| Non-Polymers* | Number of molecules | 25 |
| Total formula weight | 4756.8 | |
| All* | Total formula weight | 109678.3 |
