Ensemble refinement model

PDB 1P2Q|dpdb_41k58rfv

Ensemble refinement model

Structural consequences of accommodation of four non-cognate amino-acid residues in the S1 pocket of bovine trypsin and chymotrypsin

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
330,980
Residues
594
Protein chains
4
Alternate-location fraction
0%
Ligands
SO4, TRS

Evaluations

R-work
0.152
R-free
0.170
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Chymotrypsinogen A245—
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Pancreatic trypsin inhibitor58
  • MutationsK15F M52L

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations