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MolNFT v1 · #92360 · protein

Crystal structure of a putative member of duf 3244 protein family (BT_1867) from bacteroides thetaiotaomicron vpi-5482 at 1.69 a resolution

4G5A · Uncharacterized protein: “Crystal structure of a putative member of duf 3244 protein family (BT_1867) from bacteroides thetaiotaomicron…”. X-ray diffraction, 1 pocket (best druggability 0.69). MolNFT v1 #92360 on GenesisL1: 3D…

PDB
4G5A
Type
protein
Length
198 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
Q8A6L2
Pockets
1 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 4% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BUncharacterized proteinprotein994% helix, 54% strandQ8A6L2

Ligands and binding sites

  • GOL · Glycerol · 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
12880.690.8337GOL

Interfaces

1 interface between chains.

  • A–B · 2008 Ų buried · 32 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (engineered).

Compared structures

  • 4G5A · Crystal structure of a putative member of duf 3244 protein family (BT_1867) from… · the same entry in another collection · chain A against A, TM-score 1.00

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