Ensemble refinement model

PDB 4R93|dpdb_pgyq443i

Ensemble refinement model

BACE-1 in complex with (R)-4-(2-cyclohexylethyl)-1-methyl-5-oxo-4-(((1S,3R)-3-(3-phenylureido)cyclohexyl)methyl)imidazolidin-2-iminium

Program
PHENIX 2.0_5824
Model type
Ensemble
Purpose
Refinement
Atoms
678,695
Residues
772
Protein chains
2
Alternate-location fraction
0%
Ligands
779, TLA

Evaluations

R-work
0.149
R-free
0.183
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Beta-secretase 1414
  • ConstructUNP residues 41-454

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations