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Ensemble refinement model

PDB 4UD9|dpdb_n8jbc4qi

Ensemble refinement model

Thrombin in complex with 5-chlorothiophene-2-carboxamide

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
266,556
Residues
294
Protein chains
3
Alternate-location fraction
0%
Ligands
DMS, EDO, FQI, GOL, NA, NAG, PO4, TYS

Evaluations

R-work
0.150
R-free
0.162
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Thrombin heavy chain259
  • ConstructTHROMBIN HEAVY CHAIN, UNP RESIDUES 364-622
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Hirudin-212
  • Hirudo medicinalis6421
—
Entity 3
MoleculeChainsLengthOrganismUniProtDetails
Prothrombin28
  • ConstructTHROMBIN LIGHT CHAIN, UNP RESIDUES 333-360

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations