MolNFT v1 · #98446 · protein
Crystal structure of apo A12K/D35S mutant myo-inositol dehydrogenase from bacillus subtilis
4L9R · Inositol 2-DEHYDROGENASE/D-chiro-inositol 3-dehydrogenase: “Crystal structure of apo A12K/D35S mutant myo-inositol dehydrogenase from bacillus subtilis”. X-ray diffraction, 2 pockets (best druggability 0.64). MolNFT v1 #98446 on…
- PDB
- 4L9R
- Type
- protein
- Length
- 337 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Inositol 2-DEHYDROGENASE/D-chiro-inositol 3-dehydrogenase
- EC
- 1.1.1.18
- UniProt
- P26935
- Pockets
- 2 · best druggability 0.64
Structure
x-ray diffraction · 1 distinct chain · 39% helix, 23% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Inositol 2-DEHYDROGENASE/D-chiro-inositol 3-dehydrogenase (EC 1.1.1.18) | protein | 337 | 39% helix, 23% strand | P26935 |
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 383 | 0.64 | 0.79 | 50 | empty |
| 2 | 106 | 0.37 | 0.75 | 18 | empty |
Compared structures
- 4L9R · Crystal Structure of apo A12K/D35S mutant myo-inositol dehydrogenase from Bacillus… · the same entry in another collection · chain A against A, TM-score 1.00
- P26935 · AlphaFold monomer V2.0 prediction for inositol 2-DEHYDROGENASE/D-chiro-inositol… · a predicted model of the same protein · chain A against A, TM-score 0.99
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 P26935
- Elsewhere: RCSB PDB 4L9R · PDBe 4L9R · UniProt P26935
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