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Ensemble refinement model

PDB 1VZQ|dpdb_4qbq88kt

Ensemble refinement model

Complex of thrombin with designed inhibitor 7165

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
170,031
Residues
284
Protein chains
3
Alternate-location fraction
0%
Ligands
CA, NA, SHY

Evaluations

R-work
0.168
R-free
0.192
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
THROMBIN HEAVY250
  • ConstructSERINE PROTEASE DOMAIN, RESIDUES 364-620
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
HIRUDIN VARIANT-211
  • Hirudo medicinalis6421
  • ConstructC-TERMINAL PEPTIDE, RESIDUES 62-72
Entity 3
MoleculeChainsLengthOrganismUniProtDetails
THROMBIN LIGHT27
  • ConstructRESIDUES 334-360

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations