GL1X · GenesisL1 explorer

MolNFT v1 · #24917 · protein

Yeast MYO3 SH3 domain, triclinic crystal form

1VA7 · Myosin-3 isoform: “Yeast MYO3 SH3 domain, triclinic crystal form”. X-ray diffraction, 2 pockets (best druggability 0.38). MolNFT v1 #24917 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1VA7
Type
protein
Length
256 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Myosin-3 isoform
UniProt
P36006
Pockets
2 · best druggability 0.38

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BMyosin-3 isoformprotein684% helix, 41% strandP36006
C, DMyosin-3 isoformprotein605% helix, 47% strandP36006

Ligands and binding sites

  • GOL · Glycerol · additive · 2 copies · chains B, C, D

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1690.380.7813empty
2610.320.7616empty

Interfaces

4 interfaces between chains.

  • A–B · 505 Ų buried · 12 hydrogen bonds · protein-protein
  • A–D · 471 Ų buried · 6 hydrogen bonds · protein-protein
  • B–C · 470 Ų buried · 7 hydrogen bonds · protein-protein
  • B–D · 69 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 1VA7 · Yeast Myo3 SH3 domain, triclinic crystal form · the same entry in another collection · chain A against A, TM-score 1.00
  • P36006 · AlphaFold monomer V2.0 prediction for myosin-3 (P36006) · a predicted model of the same protein · chain C against A, TM-score 0.97

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