Ensemble refinement model

PDB 6T9V|dpdb_kfywm0am

Ensemble refinement model

Bovine Trypsin in complex with the synthetic inhibitor (S)-3-(3-(4-(3-(tert-butyl)ureido)piperidin-1-yl)-2-((3'-fluoro-4'-(hydroxymethyl)-[1,1'-biphenyl])-3-sulfonamido)-3-oxopropyl)benzimidamide (MI-1904)

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
186,289
Residues
223
Protein chains
1
Alternate-location fraction
0%
Ligands
CA, DMS, MXH, TFA

Evaluations

R-work
0.142
R-free
0.158
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Cationic Trypsin246—

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations