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MolNFT v1 · #173000 · protein

The crystal structure of human il-18 in complex with human il-18 binding protein

7AL7 · Interleukin-18-binding protein: “The crystal structure of human il-18 in complex with human il-18 binding protein”. X-ray diffraction, 1 ligand (NAG), 1 pocket (best druggability 0.34). MolNFT v1 #173000 on GenesisL1: 3D structure…

PDB
7AL7
Type
protein
Length
265 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Interleukin-18-binding protein; Glutathione S-transferase class-mu 26 kda isozyme…
EC
2.5.1.18
UniProt
O95998, Q14116
Ligands
NAG
Pockets
1 · best druggability 0.34

Structure

x-ray diffraction · 2 distinct chains · 9% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInterleukin-18-binding proteinprotein10811% helix, 48% strandO95998
BGlutathione S-transferase class-mu 26 kda isozyme, interleukin-18 (EC 2.5.1.18)protein1578% helix, 50% strandQ14116

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1570.340.7716empty

Interfaces

1 interface between chains.

  • A–B · 930 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 glycan, 2 disulfide, 2 modified (N-glycosylation, disulfide, cyclization, oxidation).

Compared structures

  • 7AL7 · The Crystal Structure of Human IL-18 in Complex With Human IL-18 Binding Protein · the same entry in another collection · chain A against A, TM-score 1.00
  • O95998 · AlphaFold monomer V2.0 prediction for interleukin-18-binding protein (O95998) · a predicted model of the same protein · chain A against A, TM-score 0.97
  • Q14116 · AlphaFold monomer V2.0 prediction for interleukin-18 (Q14116) · a predicted model of the same protein · chain B against A, TM-score 0.95

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