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MolNFT v1 · #13540 · protein

Crystal structure of MAP kinase P38 complexed to the docking site on its activator MKK3B

1LEZ · Mitogen-activated protein kinase 14: “Crystal structure of MAP kinase P38 complexed to the docking site on its activator MKK3B”. X-ray diffraction, 4 pockets (best druggability 0.66). MolNFT v1 #13540 on GenesisL1: 3D structure…

PDB
1LEZ
Type
protein
Length
351 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mitogen-activated protein kinase 14; MAP kinase kinase 3B
EC
2.7.1.-
UniProt
P47811
Pockets
4 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 40% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMitogen-activated protein kinase 14 (EC 2.7.1.-)protein34341% helix, 15% strandP47811
BMAP kinase kinase 3Bprotein80% helix, 0% strand—

Pockets

4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13020.660.8142empty
21760.510.7718empty
32430.500.7539empty
4560.280.7416empty

Interfaces

1 interface between chains.

  • A–B · 499 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 1LEZ · Crystal structure of MAP kinase P38 complexed to the docking site on its activator MKK3B · the same entry in another collection · chain A against A, TM-score 1.00
  • P47811 · AlphaFold monomer V2.0 prediction for mitogen-activated protein kinase 14 (P47811) · a predicted model of the same protein · chain A against A, TM-score 0.97

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