Deposited model

PDB 3QWC|dpdb_2vwhehpu

Deposited model

Thrombin Inhibition by Pyridin Derivatives

Program
PHENIX 1.6.4_486)
Model type
Deposited
Purpose
Reference
Authors
Biela, A., Heine, A., Klebe, G.
Atoms
2,685
Residues
290
Protein chains
3
Unmodeled fraction
5.84%
Ligand
NAG

Evaluations

R-work
0.154
R-free
0.179
Clashscore
4.2

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-213
  • Hirudo medicinalis6421
  • Constructresidues in UNP 60-72

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations