Ensemble refinement model

PDB 4WGI|dpdb_esgffrq4

Ensemble refinement model

A Single Diastereomer of a Macrolactam Core Binds Specifically to Myeloid Cell Leukemia 1 (MCL1)

Program
PHENIX 2.0_5824
Model type
Ensemble
Purpose
Refinement
Atoms
443,111
Residues
513
Protein chains
1
Alternate-location fraction
0%
Ligands
3M6, FMT, GLC, MG

Evaluations

R-work
0.163
R-free
0.211
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Maltose-binding periplasmic protein,Induced myeloid leukemia cell differentiation protein Mcl-1518
  • Escherichia coli O157:H783334
  • Homo sapiens9606
  • Constructunp residues 27-392,unp residues 173-291
  • MutationsK194A K197A R201A

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations