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MolNFT v1 · #152908 · protein

Crystal structure of semet apo SH3BP5 (P41)

6IXF · SH3 domain-binding protein 5: “Crystal structure of semet apo SH3BP5 (P41)”. X-ray diffraction, 2 pockets (best druggability 0.59). MolNFT v1 #152908 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6IXF
Type
protein
Length
443 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SH3 domain-binding protein 5
UniProt
O60239
Pockets
2 · best druggability 0.59

Structure

x-ray diffraction · 2 distinct chains · 93% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASH3 domain-binding protein 5protein22195% helix, 0% strandO60239
BSH3 domain-binding protein 5protein22291% helix, 0% strandO60239

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14150.590.7538empty
22880.550.7633empty

Interfaces

1 interface between chains.

  • A–B · 1387 Ų buried · 18 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 modified (engineered).

Compared structures

  • 6IXF · Crystal structure of SeMet apo SH3BP5 (P41) · the same entry in another collection · chain A against A, TM-score 1.00
  • O60239 · AlphaFold monomer V2.0 prediction for SH3 domain-binding protein 5 (O60239) · a predicted model of the same protein · chain B against A, TM-score 0.84

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