7JIR
The crystal structure of Papain-Like Protease of SARS CoV-2 , C111S mutant, in complex with PLP_Snyder457 inhibitor
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Papain-like protease | polymer | 318 | 35927.7 | 1 | UniProt (P0DTC1) Pfam (PF08715) UniProt (by SIFTS) (P0DTD1) In PDB | Severe acute respiratory syndrome coronavirus 2 (2019-nCoV) | Non-structural protein 3,nsp3,PL2-PRO,Papain-like proteinase,PL-PRO |
2 | A | 5-amino-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide | non-polymer | 304.4 | 1 | Chemie (TTT) | |||
3 | A | ZINC ION | non-polymer | 65.4 | 4 | Chemie (ZN) | |||
4 | A | CHLORIDE ION | non-polymer | 35.5 | 4 | Chemie (CL) | |||
5 | A | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID | non-polymer | 195.2 | 1 | Chemie (MES) | |||
6 | A | ACETATE ION | non-polymer | 59.0 | 1 | Chemie (ACT) | |||
7 | water | water | 18.0 | 139 | Chemie (HOH) |
Sequence modifications
A: 1 - 315 (UniProt: P0DTC1)
PDB | External Database | Details |
---|---|---|
Ser -2 | - | expression tag |
Asn -1 | - | expression tag |
Ala 0 | - | expression tag |
Ser 111 | Cys 1674 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 35927.7 | |
Non-Polymers* | Number of molecules | 11 |
Total formula weight | 962.1 | |
All* | Total formula weight | 36889.8 |