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MolNFT v1 · #21306 · protein

Solution structure of HBP1 sid-MSIN3A PAH2 complex

1S5R · High mobility group box transcription factor 1: “Solution structure of HBP1 sid-MSIN3A PAH2 complex”. Solution nmr, 1 pocket (best druggability 0.29). MolNFT v1 #21306 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1S5R
Type
protein
Length
112 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
High mobility group box transcription factor 1; SIN3A protein
UniProt
Q8BUS3, Q60520
Pockets
1 · best druggability 0.29

Structure

solution nmr · 2 distinct chains · 62% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHigh mobility group box transcription factor 1protein2343% helix, 0% strandQ8BUS3
BSIN3A proteinprotein8966% helix, 0% strandQ60520

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1580.290.7412empty

Interfaces

1 interface between chains.

  • A–B · 1007 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 1S5R · Solution Structure of HBP1 SID-mSin3A PAH2 Complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q60520 · AlphaFold monomer V2.0 prediction for paired amphipathic helix protein SIN3A (Q60520) · a predicted model of the same protein · chain B against A, TM-score 0.82

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