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MolNFT v1 · #103971 · protein

Crystal structure of dsba from the gram positive bacterium corynebacterium diphtheriae

4PWO: “Crystal structure of dsba from the gram positive bacterium corynebacterium diphtheriae”. X-ray diffraction, 2 pockets (best druggability 0.37). MolNFT v1 #103971 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4PWO
Type
protein
Length
250 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dsba
Pockets
2 · best druggability 0.37

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADsbaprotein25042% helix, 10% strand—

Ligands and binding sites

  • GOL · Glycerol · additive · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1630.370.7816empty
2750.360.7725empty

Compared structures

  • 4PWO · Crystal structure of DsbA from the Gram positive bacterium Corynebacterium diphtheriae · the same entry in another collection · chain A against A, TM-score 1.00

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