Ensemble refinement model

PDB 5L2Y|dpdb_skx8mu8u

Ensemble refinement model

Factor VIIa in complex with the inhibitor 1-[(2R,15R)-2-[(1-amino-4-fluoroisoquinolin-6-yl)amino]-4,15,20-trimethyl-3,12-dioxo-13-oxa-4,11-diazatricyclo[14.2.2.1~6,10~]henicosa-1(18),6,8,10(21),16,19-hexaen-7-yl] cyclobutane-1-carboxylic acid

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
182,570
Residues
309
Protein chains
2
Alternate-location fraction
0%
Ligands
70D, CA, GOL, SO4

Evaluations

R-work
0.151
R-free
0.171
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Coagulation factor VII (Heavy Chain)254—
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Coagulation factor VII (Light Chain)55—

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations