qFit model

PDB 4I11|dpdb_brjfvazk

qFit model

Structure-based design of novel dihydroisoquinoline BACE-1 inhibitors that do not engage the catalytic aspartates.

Program
Phenix 2.0_5824
Model type
Multiconformer
Purpose
Model Building
Atoms
5,147
Residues
397
Protein chains
1
Alternate-location fraction
47.36%
Ligands
1CH, ZN

Evaluations

R-work
0.195
R-free
0.241
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Beta-secretase 1406
  • ConstructBeta-secretase 1: unp residues 57-453

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations