MolNFT v1 · #156561 · protein
Crystal structure of TYLM1 S120A bound to sah and dtdp-phenol
6M83 · Dtdp-3-amino-3,6-dideoxy-alpha-D-glucopyranose N,N…: “Crystal structure of TYLM1 S120A bound to sah and dtdp-phenol”. X-ray diffraction, 3 ligands (SAH, TLO, CL), 1 pocket (best druggability 0.77). MolNFT v1 #156561 on GenesisL1: 3D…
- PDB
- 6M83
- Type
- protein
- Length
- 237 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Dtdp-3-amino-3,6-dideoxy-alpha-D-glucopyranose N,N- dimethyltransferase
- EC
- 2.1.1.235
- UniProt
- P95748
- Ligands
- SAH, TLO, CL
- Pockets
- 1 · best druggability 0.77
Structure
x-ray diffraction · 1 distinct chain · 31% helix, 38% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Dtdp-3-amino-3,6-dideoxy-alpha-D-glucopyranose N,N- dimethyltransferase (EC 2.1.1.235) | protein | 237 | 31% helix, 38% strand | P95748 |
Ligands and binding sites
- SAH · S-adenosyl-L-homocysteine · ligand · chains A
- TLO · 5'-O-[(S)-hydroxy{[(s)-hydroxy(phenoxy) phosphoryl]oxy}phosphoryl]thymidine · ligand · chains A
- CL · Chloride ion · ion · 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 | 523 | 0.77 | 0.84 | 60 | SAH, TLO |
Compared structures
- 6M83 · Crystal structure of TylM1 S120A bound to SAH and dTDP-phenol · the same entry in another collection · chain A against A, TM-score 1.00
- P95748 · AlphaFold monomer V2.0 prediction for dtdp-3-amino-3,6-dideoxy-alpha- D-glucopyranose… · a predicted model of the same protein · chain A against A, TM-score 0.99
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 P95748
- Elsewhere: RCSB PDB 6M83 · PDBe 6M83 · UniProt P95748
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