Deposited model

PDB 4AN3|dpdb_nadlxdkn

Deposited model

Crystal structures of human MEK1 with carboxamide-based allosteric inhibitor XL518 (GDC-0973), or related analogs.

Program
REFMAC 5.2.0005
Model type
Deposited
Purpose
Reference
Authors
Rice, K.D., Aay, N., Anand, N.K., Blazey, C.M., Bowles, O.J., Bussenius, J., Costanzo, S., Curtis, J.K., Defina, S.C., Dubenko, L., Engst, S., Joshi, A.A., Kennedy, A.R., Kim, A.I., Koltun, E.S., Lougheed, J.C., Manalo, J.C.L., Martini, J.F., Nuss, J.M., Peto, C.J., Tsang, T.H., Yu, P., Johnston, S.
Atoms
2,337
Residues
280
Protein chains
1
Unmodeled fraction
6.98%
Ligands
ATP, MG

Evaluations

R-work
0.226
R-free
0.283
Clashscore
11.7

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
DUAL SPECIFICITY MITOGEN-ACTIVATED PROTEIN KINASE KINASE 1301
  • ConstructPROTEIN KINASE DOMAIN, RESIDUES 61-262,305-392
  • MutationsYES

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations