9RM4
Crystal Structure of ZIKV NS2B-NS3 protease in complex with ASAP-0015373
This is a non-PDB format compatible entry.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (AAA, BBB) | Serine protease subunit NS2B,Serine protease NS3 | polymer | 214 | 23167.1 | 2 | UniProt (Q32ZE1) Pfam (PF01002) Pfam (PF00949) | Zika virus | Flavivirin protease NS2B regulatory subunit,Non-structural protein 2B,Flavivirin protease NS3 catalytic subunit,Non-structural protein 3 |
| 2 | C (BBB) | ~{N}-[3-chloranyl-5-[(2-methyl-1-oxidanyl-propan-2-yl)carbamoyl]phenyl]-5-[(dimethylamino)methyl]-1~{H}-pyrrole-2-carboxamide | non-polymer | 392.9 | 1 | Chemie (A1JHM) | |||
| 3 | D (BBB) | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
| 4 | E, F (AAA, BBB) | water | water | 18.0 | 38 | Chemie (HOH) |
Sequence modifications
AAA, BBB: 46 - 89 (UniProt: Q32ZE1)
AAA, BBB: 91 - 257 (UniProt: Q32ZE1)
| PDB | External Database | Details |
|---|---|---|
| Ser 44 | - | expression tag |
| Met 45 | - | expression tag |
| PDB | External Database | Details |
|---|---|---|
| Met 90 | - | linker |
| Lys 187 | Arg 1605 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 46334.3 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 415.9 | |
| All* | Total formula weight | 46750.1 |
