MolNFT v1 · #110136 · protein
X-ray structure of PEPTST1
4XNI · Di-or TRIPEPTIDE:H+ symporter: “X-ray structure of PEPTST1”. X-ray diffraction, 2 ligands (78M, PO4), 4 pockets (best druggability 0.78). MolNFT v1 #110136 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 4XNI
- Type
- protein
- Length
- 447 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Di-or TRIPEPTIDE:H+ symporter
- UniProt
- Q5M4H8
- Ligands
- 78M, PO4
- Pockets
- 4 · best druggability 0.78
Structure
x-ray diffraction · 1 distinct chain · 81% helix, 1% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Di-or TRIPEPTIDE:H+ symporter | protein | 447 | 81% helix, 1% strand | Q5M4H8 |
Ligands and binding sites
- 78M · (2S)-2,3-dihydroxypropyl(7z)-pentadec-7-enoate · ligand · 10 copies · chains A
- PO4 · Phosphate ion · ion · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 707 | 0.78 | 0.82 | 52 | empty |
| 2 | 373 | 0.61 | 0.76 | 36 | empty |
| 3 | 87 | 0.45 | 0.80 | 17 | empty |
| 4 | 50 | 0.42 | 0.83 | 13 | empty |
Compared structures
- 4XNI · X-ray structure of PepTst1 · 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 Q5M4H8
- Elsewhere: RCSB PDB 4XNI · PDBe 4XNI · UniProt Q5M4H8
GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.