PDB entry 4nvj
View 4nvj on RCSB PDB site
Description: Predicting protein conformational response in prospective ligand discovery.
Class: oxidoreductase
Keywords: Model system, flexibility, dynamic, loop, side-chains, energy penalty, occupancy, Boltzmann weights, flexible docking, ligand binding, OXIDOREDUCTASE
Deposited on
2013-12-05, released
2013-12-25
The last revision prior to the SCOPe 2.04 freeze date was dated
2013-12-25, with a file datestamp of
2013-12-20.
Experiment type: XRAY
Resolution: 1.81 Å
R-factor: 0.157
AEROSPACI score: 0.46
(click here for full SPACI score report)
Chains and heterogens:
- Chain 'B':
Compound: cytochrome c peroxidase
Species: Saccharomyces cerevisiae [TaxId:285006]
Gene: CCP1 CCP CPO YKR066C, SCRG_04081
Database cross-references and differences (RAF-indexed):
- Uniprot B3LRE1 (0-288)
- engineered mutation (186-187)
Domains in SCOPe 2.04: d4nvjb_ - Heterogens: HEM, 2NX, MES, HOH