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MolNFT v1 · #9945 · protein

NMR structure of DFF40 and DFF45 N-terminal domain complex

1IBX · DNA fragmentation factor 40: “NMR structure of DFF40 and DFF45 N-terminal domain complex”. Solution nmr, 2 pockets (best druggability 0.63). MolNFT v1 #9945 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1IBX
Type
protein
Length
170 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA fragmentation factor 40; Chimera of IgG binding protein G and DNA fragmentation…
EC
3.-.-.-
UniProt
O76075, P19909
Pockets
2 · best druggability 0.63

Structure

solution nmr · 2 distinct chains · 17% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA fragmentation factor 40 (EC 3.-.-.-)protein8114% helix, 16% strandO76075
BChimera of IgG binding protein G and DNA fragmentation factor 45protein8920% helix, 15% strandP19909

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1850.630.8924empty
21040.390.7624empty

Interfaces

1 interface between chains.

  • A–B · 669 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 1IBX · NMR structure of DFF40 and DFF45 N-terminal domain complex · the same entry in another collection · chain A against A, TM-score 1.00
  • O76075 · AlphaFold monomer V2.0 prediction for DNA fragmentation factor subunit beta (O76075) · a predicted model of the same protein · chain A against A, TM-score 0.62
  • P19909 · AlphaFold monomer V2.0 prediction for immunoglobulin G-binding protein G (P19909) · a predicted model of the same protein · chain B against A, TM-score 0.45

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