Ensemble refinement model

PDB 2FI3|dpdb_h81wbvzr

Ensemble refinement model

Crystal structure of a BPTI variant (Cys14->Ser, Cys38->Ser) in complex with trypsin

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
238,287
Residues
281
Protein chains
2
Alternate-location fraction
0%
Ligands
CA, EDO, NA, SO4

Evaluations

R-work
0.152
R-free
0.179
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Cationic trypsin223—
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Pancreatic trypsin inhibitor58
  • MutationsC14S C38S

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations