GL1X · GenesisL1 explorer

MolNFT v1 · #172888 · protein

Nf-Y bound to suramin inhibitor

7AH8 · Nuclear transcription factor Y subunit beta: “Nf-Y bound to suramin inhibitor”. X-ray diffraction, 1 ligand (SVR), 1 pocket (best druggability 0.69). MolNFT v1 #172888 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7AH8
Type
protein
Length
336 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nuclear transcription factor Y subunit beta; Isoform 6 of nuclear transcription factor Y…
UniProt
P25208, Q13952
Ligands
SVR
Pockets
1 · best druggability 0.69

Structure

x-ray diffraction · 4 distinct chains · 66% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANuclear transcription factor Y subunit betaprotein8869% helix, 3% strandP25208
BIsoform 6 of nuclear transcription factor Y subunit gammaprotein7963% helix, 4% strandQ13952
CNuclear transcription factor Y subunit betaprotein8969% helix, 3% strandP25208
DIsoform 6 of nuclear transcription factor Y subunit gammaprotein8064% helix, 4% strandQ13952

Ligands and binding sites

  • SVR · 8,8'-[carbonylbis[imino-3,1-phenylenecarbonylimino(4-methyl-3,1-phenylene)carbonylimino]]bis-1,3,5-naphthalenetrisulfonic acid · ligand · chains A, B, C, D
  • GOL · Glycerol · additive · chains B, D
  • FLC · Citrate anion · additive

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15360.690.7842GOL, SVR

Interfaces

5 interfaces between chains.

  • C–D · 2391 Ų buried · 15 hydrogen bonds · protein-protein
  • A–B · 2344 Ų buried · 14 hydrogen bonds · protein-protein
  • B–C · 111 Ų buried · 1 hydrogen bond · protein-protein
  • A–D · 63 Ų buried · 0 hydrogen bonds · protein-protein
  • B–D · 54 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7AH8 · NF-Y bound to suramin inhibitor · the same entry in another collection · chain D against D, TM-score 1.00
  • Q13952 · AlphaFold monomer V2.0 prediction for nuclear transcription factor Y subunit gamma… · a predicted model of the same protein · chain B against A, TM-score 0.97
  • P25208 · AlphaFold monomer V2.0 prediction for nuclear transcription factor Y subunit beta (P25208) · a predicted model of the same protein · chain A against A, TM-score 0.94

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