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MolNFT v1 · #151798 · protein

Crystal structure of the third fniii domain from rat BETA4 integrin, a binding site for periaxin

6HYF · Integrin beta-4: “Crystal structure of the third fniii domain from rat BETA4 integrin, a binding site for periaxin”. X-ray diffraction, 4 pockets (best druggability 0.54). MolNFT v1 #151798 on GenesisL1: 3D structure, binding sites…

PDB
6HYF
Type
protein
Length
379 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Integrin beta-4
UniProt
Q64632
Pockets
4 · best druggability 0.54

Structure

x-ray diffraction · 4 distinct chains · 0% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIntegrin beta-4protein1060% helix, 44% strandQ64632
BIntegrin beta-4protein1000% helix, 50% strandQ64632
CIntegrin beta-4protein910% helix, 52% strandQ64632
DIntegrin beta-4protein820% helix, 51% strandQ64632

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1530.540.8919empty
21710.440.7527empty
31280.440.7727empty
4910.390.7729empty

Interfaces

3 interfaces between chains.

  • A–B · 928 Ų buried · 15 hydrogen bonds · protein-protein
  • B–C · 548 Ų buried · 11 hydrogen bonds · protein-protein
  • C–D · 488 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 6HYF · Crystal structure of the third FNIII domain from rat beta4 integrin, a binding site for… · the same entry in another collection · chain D against D, TM-score 1.00
  • Q64632 · AlphaFold monomer V2.0 prediction for integrin beta-4 (Q64632) · a predicted model of the same protein · chain C against A, TM-score 0.96

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