GL1X · GenesisL1 explorer

MolNFT v1 · #81932 · protein

DIP2269 protein from corynebacterium diphtheriae

3V7B · Uncharacterized protein: “DIP2269 protein from corynebacterium diphtheriae”. X-ray diffraction, 1 pocket (best druggability 0.73). MolNFT v1 #81932 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3V7B
Type
protein
Length
289 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
Q6NEK4
Pockets
1 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 27% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUncharacterized proteinprotein14727% helix, 29% strandQ6NEK4
BUncharacterized proteinprotein14226% helix, 30% strandQ6NEK4

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 2 copies · chains A, B

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.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18720.730.7753EDO

Interfaces

1 interface between chains.

  • A–B · 267 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 modified, 2 disulfide (engineered, disulfide).

Compared structures

  • 3V7B · Dip2269 protein from corynebacterium diphtheriae · the same entry in another collection · chain A against A, TM-score 1.00

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