MolNFT v1 · #73848 · protein

Crystal structure of Y323F inactive mutant of P38ALPHA MAP kinase

3OEF · Mitogen-activated protein kinase 14: “Crystal structure of Y323F inactive mutant of P38ALPHA MAP kinase”. X-ray diffraction, 5 pockets (best druggability 0.67). MolNFT v1 #73848 on GenesisL1: 3D structure, binding sites and pockets…

PDB: 3OEF
Type: protein
Length: 334 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Mitogen-activated protein kinase 14
EC: 2.7.11.24
UniProt: Q16539
Pockets: 5 · best druggability 0.67

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 16% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
X	Mitogen-activated protein kinase 14 (EC 2.7.11.24)	protein	334	39% helix, 16% strand	Q16539

Ligands and binding sites

BOG · octyl beta-D-glucopyranoside · additive · 2 copies · chains X

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

5 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	199	0.67	0.85	27	BOG
2	313	0.64	0.80	59	empty
3	112	0.38	0.74	19	empty
4	81	0.34	0.75	19	empty
5	56	0.28	0.74	16	empty

Compared structures

3OEF · Crystal structure of Y323F inactive mutant of p38alpha MAP kinase · the same entry in another collection · chain X against X, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt Q16539
Elsewhere: RCSB PDB 3OEF · PDBe 3OEF · UniProt Q16539

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