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MolNFT v1 · #11251 · protein

Crystal structure of stall-1 of TNF family ligand

1JH5 · Tumor necrosis factor ligand superfamily member 13B: “Crystal structure of stall-1 of TNF family ligand”. X-ray diffraction, 17 pockets (best druggability 0.78). MolNFT v1 #11251 on GenesisL1: 3D structure, binding sites and pockets…

PDB
1JH5
Type
protein
Length
1,440 residues
Chains
10
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tumor necrosis factor ligand superfamily member 13B
UniProt
Q9Y275
Pockets
17 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 0% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, G, H, I, JTumor necrosis factor ligand superfamily member 13Bprotein1440% helix, 54% strandQ9Y275

Pockets

17 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1750.780.9917empty
21530.780.9526empty
3720.770.9916empty
41530.770.9424empty
5700.760.9913empty

Interfaces

17 interfaces between chains.

  • E–F · 967 Ų buried · 22 hydrogen bonds · protein-protein
  • A–B · 966 Ų buried · 23 hydrogen bonds · protein-protein
  • D–F · 966 Ų buried · 23 hydrogen bonds · protein-protein
  • D–E · 966 Ų buried · 23 hydrogen bonds · protein-protein
  • A–C · 965 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • 1JH5 · Crystal Structure of sTALL-1 of TNF family ligand · the same entry in another collection · chain J against J, TM-score 1.00
  • Q9Y275 · AlphaFold monomer V2.0 prediction for tumor necrosis factor ligand superfamily member 13B… · a predicted model of the same protein · chain A against A, TM-score 0.99

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