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X-ray structure of the fdtf formyltransferase from salmonella enteric O60 in complex with tdp-FUC3N and folinic acid
Analyse X-ray structure of the fdtf formyltransferase from salmonella enteric O60 in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 5UIK
- Type
- protein
- Length
- 796 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Formyltransferase
- UniProt
- U3GK13
- Ligands
- T3F, FON, NA
- Pockets
- 9 · best druggability 0.74
Structure
x-ray diffraction · 2 distinct chains · 36% helix, 18% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Formyltransferase | protein | 398 | 36% helix, 18% strand | U3GK13 |
| B | Formyltransferase | protein | 398 | 35% helix, 17% strand | U3GK13 |
Ligands and binding sites
- T3F · (3R,4S,5R,6R)-4-amino-3,5-dihydroxy-6-methyloxan-2-yl][hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate · ligand · 4 copies · chains A, B
- FON · N-{[4-({[(6R)-2-amino-5-formyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)phenyl]carbonyl}-L-glutamic acid · ligand · 2 copies · chains A, B
- NA · Sodium ion · metal · 3 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
9 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 573 | 0.74 | 0.81 | 54 | FON, T3F |
| 2 | 504 | 0.73 | 0.81 | 47 | FON, T3F |
| 3 | 788 | 0.72 | 0.77 | 59 | empty |
| 4 | 503 | 0.64 | 0.76 | 65 | empty |
| 5 | 436 | 0.60 | 0.75 | 54 | T3F |
Interfaces
1 interface between chains.
- A–B · 1361 Ų buried · 21 hydrogen bonds · protein-protein
Compared structures
- 5UIK · X-ray structure of the FdtF formyltransferase from salmonella enteric O60 in complex with… · 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 U3GK13
- Elsewhere: RCSB PDB 5UIK · PDBe 5UIK · UniProt U3GK13
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