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Src family kinase hck SH3 domain

Analyse Src family kinase hck SH3 domain in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1BU1
Type
protein
Length
339 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein (hemopoietic cell kinase)
EC
2.7.1.112
UniProt
P08631
Pockets
4 · best druggability 0.58

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, EProtein (hemopoietic cell kinase) (EC 2.7.1.112)protein575% helix, 49% strandP08631
C, D, FProtein (hemopoietic cell kinase) (EC 2.7.1.112)protein565% helix, 48% strandP08631

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12900.580.7727empty
21380.420.7518empty
3860.320.7320empty
4570.300.7513empty

Interfaces

7 interfaces between chains.

  • A–B · 503 Ų buried · 4 hydrogen bonds · protein-protein
  • C–E · 437 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 333 Ų buried · 7 hydrogen bonds · protein-protein
  • A–D · 297 Ų buried · 4 hydrogen bonds · protein-protein
  • A–F · 219 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 1BU1 · Src family kinase hck SH3 domain · the same entry in another collection · chain F against F, TM-score 1.00
  • P08631 · AlphaFold monomer V2.0 prediction for tyrosine-protein kinase hck (P08631) · a predicted model of the same protein · chain C against A, TM-score 0.96

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