MolNFT v1 · #139123 · protein
Crystal structure of a hydrolase encoded by LIN2189 from listeria innocua
5X5M · LIN2189 protein: “Crystal structure of a hydrolase encoded by LIN2189 from listeria innocua”. X-ray diffraction, 1 ligand (7YU), 4 pockets (best druggability 0.62). MolNFT v1 #139123 on GenesisL1: 3D structure, binding sites and…
- PDB
- 5X5M
- Type
- protein
- Length
- 410 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- LIN2189 protein
- UniProt
- Q929T5
- Ligands
- 7YU
- Pockets
- 4 · best druggability 0.62
Structure
x-ray diffraction · 1 distinct chain · 33% helix, 31% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | LIN2189 protein | protein | 205 | 33% helix, 31% strand | Q929T5 |
Ligands and binding sites
- 7YU · (+)-Yatakemycin · ligand · 2 copies · chains A, B
- DMS · Dimethyl sulfoxide · additive · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 336 | 0.62 | 0.78 | 45 | DMS, 7YU |
| 2 | 340 | 0.62 | 0.78 | 43 | DMS, 7YU |
| 3 | 336 | 0.55 | 0.75 | 44 | empty |
| 4 | 87 | 0.41 | 0.78 | 18 | empty |
Interfaces
1 interface between chains.
- A–B · 336 Ų buried · 1 hydrogen bond · protein-protein
Compared structures
- 5X5M · Crystal structure of a hydrolase encoded by lin2189 from Listeria innocua · 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 Q929T5
- Elsewhere: RCSB PDB 5X5M · PDBe 5X5M · UniProt Q929T5
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