Research workbench
Lare, a sulfur transferase involved in synthesis of the cofactor for lactate racemase, apo form
Analyse Lare, a sulfur transferase involved in synthesis of the cofactor for lactate… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 5UDQ
- Type
- protein
- Length
- 1,509 residues
- Chains
- 6
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Lactate racemization operon protein lare
- UniProt
- F9UST4
- Ligands
- SO4, PO4
- Pockets
- 20 · best druggability 0.82
Structure
x-ray diffraction · 6 distinct chains · 53% helix, 14% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Lactate racemization operon protein lare | protein | 263 | 54% helix, 13% strand | F9UST4 |
| B | Lactate racemization operon protein lare | protein | 245 | 51% helix, 15% strand | F9UST4 |
| C | Lactate racemization operon protein lare | protein | 249 | 53% helix, 14% strand | F9UST4 |
| D | Lactate racemization operon protein lare | protein | 240 | 52% helix, 15% strand | F9UST4 |
| E | Lactate racemization operon protein lare | protein | 262 | 53% helix, 14% strand | F9UST4 |
| F | Lactate racemization operon protein lare | protein | 250 | 53% helix, 14% strand | F9UST4 |
Ligands and binding sites
- SO4 · Sulfate ion · ion · 8 copies · chains A, B, C, D, E, F
- PO4 · Phosphate ion · ion · 6 copies · chains A, B, C, D, E, F
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
20 pockets found on a 1 Å grid, 13 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 217 | 0.82 | 0.95 | 44 | empty |
| 2 | 672 | 0.71 | 0.78 | 67 | SO4 |
| 3 | 384 | 0.70 | 0.82 | 38 | SO4 |
| 4 | 507 | 0.68 | 0.78 | 48 | SO4 |
| 5 | 370 | 0.67 | 0.80 | 40 | SO4 |
Interfaces
13 interfaces between chains.
- C–E · 1167 Ų buried · 6 hydrogen bonds · protein-protein
- A–F · 1086 Ų buried · 6 hydrogen bonds · protein-protein
- B–D · 849 Ų buried · 4 hydrogen bonds · protein-protein
- A–C · 678 Ų buried · 11 hydrogen bonds · protein-protein
- E–F · 611 Ų buried · 11 hydrogen bonds · protein-protein
Compared structures
- 5UDQ · LarE, a sulfur transferase involved in synthesis of the cofactor for lactate racemase… · the same entry in another collection · chain F against F, TM-score 1.00
- F9UST4 · AlphaFold monomer V2.0 prediction for pyridinium-3,5-bisthiocarboxylic acid… · a predicted model of the same protein · chain B against A, TM-score 0.97
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 F9UST4
- Elsewhere: RCSB PDB 5UDQ · PDBe 5UDQ · UniProt F9UST4
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