MolNFT v1 · #56268 · protein
Crystal structure of cert start DOMAIN(N504A mutant), in complex with C10-diacylglycerol
2Z9Z · Lipid-transfer protein cert: “Crystal structure of cert start DOMAIN(N504A mutant), in complex with C10-diacylglycerol”. X-ray diffraction, 1 ligand (DDR), 3 pockets (best druggability 0.87). MolNFT v1 #56268 on GenesisL1: 3D…
- PDB
- 2Z9Z
- Type
- protein
- Length
- 235 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Lipid-transfer protein cert
- UniProt
- Q53YV2
- Ligands
- DDR
- Pockets
- 3 · best druggability 0.87
Structure
x-ray diffraction · 1 distinct chain · 26% helix, 37% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Lipid-transfer protein cert | protein | 235 | 26% helix, 37% strand | Q53YV2 |
Ligands and binding sites
- DDR · (2S)-3-hydroxypropane-1,2-diyl didecanoate · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 442 | 0.87 | 0.94 | 47 | DDR |
| 2 | 92 | 0.37 | 0.76 | 17 | empty |
| 3 | 65 | 0.30 | 0.74 | 18 | empty |
Compared structures
- 2Z9Z · Crystal structure of CERT START domain(N504A mutant), in complex with C10-diacylglycerol · 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 Q53YV2
- Elsewhere: RCSB PDB 2Z9Z · PDBe 2Z9Z · UniProt Q53YV2
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