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MolNFT v1 · #30074 · protein

Beta pix-SH3 complexed with an atypical peptide from alpha-pak

1ZSG · Rho guanine nucleotide exchange factor 7: “Beta pix-SH3 complexed with an atypical peptide from alpha-pak”. Solution nmr, 1 pocket (best druggability 0.47). MolNFT v1 #30074 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
1ZSG
Type
protein
Length
87 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Rho guanine nucleotide exchange factor 7; SERINE/THREONINE-protein kinase pak 1
EC
2.7.1.37
UniProt
Q14155, Q13153
Pockets
1 · best druggability 0.47

Structure

solution nmr · 2 distinct chains · 0% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARho guanine nucleotide exchange factor 7protein650% helix, 43% strandQ14155
BSERINE/THREONINE-protein kinase pak 1 (EC 2.7.1.37)protein220% helix, 0% strandQ13153

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1620.470.8414empty

Interfaces

1 interface between chains.

  • A–B · 579 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 1ZSG · beta PIX-SH3 complexed with an atypical peptide from alpha-PAK · the same entry in another collection · chain A against A, TM-score 1.00
  • Q14155 · AlphaFold monomer V2.0 prediction for rho guanine nucleotide exchange factor 7 (Q14155) · a predicted model of the same protein · chain A against A, TM-score 0.77
  • Q13153 · AlphaFold monomer V2.0 prediction for SERINE/THREONINE-protein kinase pak 1 (Q13153) · a predicted model of the same protein · chain B against A, TM-score 0.18

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