MolNFT v1 · #37168 · protein
Mitogen activated protein kinase P38ALPHA (D176A+F327S) activating mutant form-B
2FSM · Mitogen-activated protein kinase 14: “Mitogen activated protein kinase P38ALPHA (D176A+F327S) activating mutant form-B”. X-ray diffraction, 7 pockets (best druggability 0.64). MolNFT v1 #37168 on GenesisL1: 3D structure, binding…
- PDB
- 2FSM
- Type
- protein
- Length
- 326 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Mitogen-activated protein kinase 14
- EC
- 2.7.1.37
- UniProt
- Q16539
- Pockets
- 7 · best druggability 0.64
Structure
x-ray diffraction · 1 distinct chain · 37% helix, 15% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| X | Mitogen-activated protein kinase 14 (EC 2.7.1.37) | protein | 326 | 37% helix, 15% strand | Q16539 |
Ligands and binding sites
- BOG · octyl beta-D-glucopyranoside · additive · chains X
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
7 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 224 | 0.64 | 0.82 | 29 | BOG |
| 2 | 185 | 0.57 | 0.80 | 22 | empty |
| 3 | 169 | 0.55 | 0.80 | 20 | empty |
| 4 | 131 | 0.45 | 0.77 | 18 | empty |
| 5 | 80 | 0.36 | 0.76 | 17 | empty |
Compared structures
- 2FSM · mitogen activated protein kinase p38alpha (D176A+F327S) activating mutant form-B · 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 2FSM · PDBe 2FSM · UniProt Q16539
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