Ensemble refinement model

PDB 2CF9|dpdb_khp194e4

Ensemble refinement model

Complex of recombinant human thrombin with an inhibitor

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
101,341
Residues
283
Protein chains
3
Alternate-location fraction
0%
Ligands
348, CA, NA, SIN

Evaluations

R-work
0.185
R-free
0.219
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
THROMBIN HEAVY CHAIN257
  • ConstructCATALYTIC, RESIDUES 364-620
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
HIRUDIN IIIA11
  • Hirudo medicinalis6421
  • ConstructC-TERMINUS, RESIDUES 55-65
Entity 3
MoleculeChainsLengthOrganismUniProtDetails
THROMBIN LIGHT CHAIN28
  • ConstructLIGHT CHAIN, RESIDUES 334-361

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations