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MolNFT v1 · #118116 · protein

Crystal structure of group a streptococcus hupz

5ESC: “Crystal structure of group a streptococcus hupz”. X-ray diffraction, 11 pockets (best druggability 0.64). MolNFT v1 #118116 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5ESC
Type
protein
Length
476 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hupz
UniProt
Q1JHG0
Pockets
11 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 24% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DHupzprotein11924% helix, 45% strandQ1JHG0

Pockets

11 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11150.640.8818empty
21040.610.8714empty
32730.540.7629empty
42350.540.7729empty
52280.540.7729empty

Interfaces

5 interfaces between chains.

  • C–D · 1093 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 1081 Ų buried · 11 hydrogen bonds · protein-protein
  • A–C · 567 Ų buried · 5 hydrogen bonds · protein-protein
  • A–D · 79 Ų buried · 1 hydrogen bond · protein-protein
  • B–C · 78 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 5ESC · Crystal structure of Group A Streptococcus HupZ · the same entry in another collection · chain A against A, TM-score 1.00

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