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MolNFT v1 · #50199 · protein

Crystal structure of E.COLI hype

2RB9 · Hype protein: “Crystal structure of E.COLI hype”. X-ray diffraction, 15 pockets (best druggability 0.81). MolNFT v1 #50199 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2RB9
Type
protein
Length
1,289 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hype protein
UniProt
Q7ABB2
Pockets
15 · best druggability 0.81

Structure

x-ray diffraction · 2 distinct chains · 36% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CHype proteinprotein32234% helix, 25% strandQ7ABB2
DHype proteinprotein32337% helix, 25% strandQ7ABB2

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111490.810.82104empty
27330.810.8574empty
36800.750.8165empty
46410.750.8157empty
54480.720.8249empty

Interfaces

3 interfaces between chains.

  • C–D · 2794 Ų buried · 49 hydrogen bonds · protein-protein
  • A–B · 2704 Ų buried · 44 hydrogen bonds · protein-protein
  • B–D · 572 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 2RB9 · Crystal structure of E.coli HypE · the same entry in another collection · chain A against A, TM-score 1.00

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