MolNFT v1 · #144126 · protein
Crystal structure of OS79 from O. sativa in complex with udp and deoxynivalenol-3-glucoside (glucose moitey not resolved)
6BK3 · Udp-glycosyltransferase 79: “Crystal structure of OS79 from O. sativa in complex with udp and deoxynivalenol-3-glucoside (glucose moitey…”. X-ray diffraction, 2 ligands (UDP, B2S), 5 pockets (best druggability 0.64). MolNFT v1…
- PDB
- 6BK3
- Type
- protein
- Length
- 433 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Udp-glycosyltransferase 79
- EC
- 2.4.1.-
- UniProt
- Q7XT97
- Ligands
- UDP, B2S
- Pockets
- 5 · best druggability 0.64
Structure
x-ray diffraction · 1 distinct chain · 48% helix, 13% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Udp-glycosyltransferase 79 (EC 2.4.1.-) | protein | 433 | 48% helix, 13% strand | Q7XT97 |
Ligands and binding sites
- UDP · Uridine-5'-diphosphate · ligand · chains A
- B2S · (3alpha,7alpha)-3,7,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
5 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 425 | 0.64 | 0.77 | 35 | B2S |
| 2 | 202 | 0.48 | 0.75 | 33 | empty |
| 3 | 163 | 0.45 | 0.75 | 29 | UDP |
| 4 | 68 | 0.38 | 0.79 | 16 | empty |
| 5 | 53 | 0.34 | 0.78 | 16 | empty |
Compared structures
- 6BK3 · Crystal structure of Os79 from O. sativa in complex with UDP and… · the same entry in another collection · chain A against A, TM-score 1.00
- Q7XT97 · AlphaFold monomer V2.0 prediction for udp-glycosyltransferase 79 (Q7XT97) · a predicted model of the same protein · chain A against A, TM-score 0.98
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 Q7XT97
- Elsewhere: RCSB PDB 6BK3 · PDBe 6BK3 · UniProt Q7XT97
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