GL1X · GenesisL1 explorer

MolNFT v1 · #160854 · protein

Ewingella americana HOPBF1 kinase

6PWD · Type III effector HOPBF1: “Ewingella americana HOPBF1 kinase”. X-ray diffraction, 1 ligand (SO4), 1 pocket (best druggability 0.66). MolNFT v1 #160854 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6PWD
Type
protein
Length
176 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Type III effector HOPBF1
UniProt
A0A2N0N2I2
Ligands
SO4
Pockets
1 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AType III effector HOPBF1protein17635% helix, 26% strandA0A2N0N2I2

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A

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
11990.660.8527EDO

Compared structures

  • 6PWD · Ewingella americana HopBF1 kinase · the same entry in another collection · chain A against A, TM-score 1.00

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