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MolNFT v1 · #49518 · protein

Crystal structure of novel immune-type receptor 11 extracellular fragment from ictalurus punctatus

2QQQ: “Crystal structure of novel immune-type receptor 11 extracellular fragment from ictalurus punctatus”. X-ray diffraction, 5 pockets (best druggability 0.67). MolNFT v1 #49518 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
2QQQ
Type
protein
Length
436 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Novel immune-type receptor 11
UniProt
Q8UWK4
Pockets
5 · best druggability 0.67

Structure

x-ray diffraction · 1 distinct chain · 6% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DNovel immune-type receptor 11protein1096% helix, 51% strandQ8UWK4

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14810.670.7951empty
21210.500.8024empty
31280.490.8032empty
4940.400.7714empty
5560.290.7513empty

Interfaces

5 interfaces between chains.

  • A–B · 1257 Ų buried · 11 hydrogen bonds · protein-protein
  • C–D · 1241 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 333 Ų buried · 4 hydrogen bonds · protein-protein
  • B–D · 313 Ų buried · 5 hydrogen bonds · protein-protein
  • B–C · 217 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 2QQQ · Crystal Structure of Novel Immune-Type Receptor 11 Extracellular Fragment from Ictalurus… · the same entry in another collection · chain A against A, TM-score 1.00

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