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Ensemble refinement model

PDB 1O5G|dpdb_n0r087sr

Ensemble refinement model

Dissecting and Designing Inhibitor Selectivity Determinants at the S1 site Using an Artificial Ala190 Protease (Ala190 uPA)

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
124,869
Residues
293
Protein chains
3
Alternate-location fraction
0%
Ligands
CA, CR9, NA, TYS

Evaluations

R-work
0.166
R-free
0.208
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Prothrombin36
  • ConstructLIGHT CHAIN, RESIDUES 328-363
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Prothrombin259
  • ConstructHEAVY CHAIN, RESIDUES 364-620
Entity 3
MoleculeChainsLengthOrganismUniProtDetails
Hirudin IIIB'11
  • Hirudo medicinalis6421
—

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations