Ensemble refinement model

PDB 4I0E|dpdb_nss2s06k

Ensemble refinement model

Design and Synthesis of Thiophene Dihydroisoquinolins as Novel BACE-1 Inhibitors

Program
PHENIX 2.0_5824
Model type
Ensemble
Purpose
Refinement
Atoms
74,414
Residues
393
Protein chains
1
Alternate-location fraction
0%
Ligands
1B8, ZN

Evaluations

R-work
0.223
R-free
0.256
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Beta-secretase 1406
  • Constructunp residues 57-453

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations