Ensemble refinement model

PDB 3EQ0|dpdb_jxm4uk92

Ensemble refinement model

Thrombin Inhibitor

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
124,785
Residues
282
Protein chains
3
Alternate-location fraction
0%
Ligands
2TS, NA, TYS

Evaluations

R-work
0.194
R-free
0.236
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Thrombin Light Chain36—
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Thrombin Heavy Chain259—
Entity 3
MoleculeChainsLengthOrganismUniProtDetails
Hirudin variant-111
  • Hirudo medicinalis6421
  • ConstructResidues 54-64

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations