Ensemble refinement model

PDB 1O5B|dpdb_1yhbwota

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
106,444
Residues
253
Protein chains
2
Alternate-location fraction
0%
Ligands
CIT, ESI

Evaluations

R-work
0.179
R-free
0.245
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Urokinase-type plasminogen activator23
  • ConstructSHORT CHAIN
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Urokinase-type plasminogen activator253
  • ConstructCATALYTIC DOMAIN
  • MutationsN145A/S190A

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations