Ensemble refinement model

PDB 5F01|dpdb_qiewioxb

Ensemble refinement model

CRYSTAL STRUCTURE OF BACE-1 IN COMPLEX WITH (1SR,2SR)-2-((R)-2-amino-5,5-difluoro-4-methyl-5,6-dihydro-4H-1,3-oxazin-4-yl)-N-(3-chloroquinolin-8-yl)cyclopropanecarboxamide

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
221,917
Residues
384
Protein chains
1
Alternate-location fraction
0%
Ligands
5T7, ACT, DMS, GOL, NA

Evaluations

R-work
0.170
R-free
0.192
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Beta-secretase 1390
  • MutationK307A

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations