Deposited model

PDB 4B00|dpdb_cxms7l8t

Deposited model

Design and Synthesis of BACE1 Inhibitors with In Vivo Brain Reduction of beta-Amyloid Peptides (COMPOUND (R)-41)

Program
BUSTER 2.11.1
Model type
Deposited
Purpose
Reference
Authors
Swahn, B.M., Kolmodin, K., Karlstrom, S., von Berg, S., Soderman, P., Holenz, J., Berg, S., Lindstrom, J., Sundstrom, M., Turek, D., Kihlstrom, J., Slivo, C., Andersson, L., Pyring, D., Ohberg, L., Kers, A., Bogar, K., Bergh, M., Olsson, L.L., Janson, J., Eketjall, S., Georgievska, B., Jeppsson, F., Falting, J.
Atoms
3,390
Residues
375
Protein chains
1
Unmodeled fraction
8.76%

Evaluations

R-work
0.173
R-free
0.226
Clashscore
3.0

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
BETA-SECRETASE 1411
  • ConstructRESIDUES 43-453
  • MutationsYES

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations