MolNFT v1 · #62603 · protein
Crystal structure of ibv X-domain at pH 5.6
3EKE · Non-structural protein 3: “Crystal structure of ibv X-domain at pH 5.6”. X-ray diffraction, 1 pocket (best druggability 0.56). MolNFT v1 #62603 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 3EKE
- Type
- protein
- Length
- 171 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Non-structural protein 3
- EC
- 3.4.22.-
- UniProt
- P0C6Y1
- Pockets
- 1 · best druggability 0.56
Structure
x-ray diffraction · 1 distinct chain · 39% helix, 20% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Non-structural protein 3 (EC 3.4.22.-) | protein | 171 | 39% helix, 20% strand | P0C6Y1 |
Ligands and binding sites
- TLA · L(+)-tartaric acid · additive · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 234 | 0.56 | 0.78 | 38 | TLA |
Compared structures
- 3EKE · Crystal structure of IBV X-domain at pH 5.6 · the same entry in another collection · chain A against A, 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 P0C6Y1
- Elsewhere: RCSB PDB 3EKE · PDBe 3EKE · UniProt P0C6Y1
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