MolNFT v1 · #172091 · protein
[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE phosphodiesterase 2 inhibitors
6ZQZ: “[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE phosphodiesterase 2 inhibitors”. X-ray diffraction, 3 ligands (QOQ, MG, ZN). MolNFT v1 #172091 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6ZQZ
- Type
- protein
- Length
- 1,339 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- O00408
- Ligands
- QOQ, MG, ZN
Structure
x-ray diffraction · 4 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 339 | — | O00408 |
| B | — | protein | 337 | — | O00408 |
| C | — | protein | 327 | — | O00408 |
| D | — | protein | 336 | — | O00408 |
Ligands and binding sites
- QOQ · 5-[bis(fluoranyl)methyl]-7-[(3~{S})-1-[(2-chloranyl-6-methyl-pyridin-4-yl)methyl]piperidin-3-yl]-[1,2, 4]triazolo[1,5-a]pyrimidine · ligand · 4 copies · chains A, B, C, D
- MG · Magnesium ion · metal · 5 copies · chains A, B, C, D
- ZN · Zinc ion · metal · 4 copies · chains A, B, C, D
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6ZQZ · [1,2,4]Triazolo[1,5-a]pyrimidine Phosphodiesterase 2 Inhibitors · 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 O00408
- Elsewhere: RCSB PDB 6ZQZ · PDBe 6ZQZ · UniProt O00408
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