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MolNFT v1 · #77728 · protein

Crystal structure of the complex between mouse pd-1 mutant and pd-L2 igv domain

3RNK · Programmed cell death protein 1: “Crystal structure of the complex between mouse pd-1 mutant and pd-L2 igv domain”. X-ray diffraction, 1 pocket (best druggability 0.31). MolNFT v1 #77728 on GenesisL1: 3D structure, binding sites and…

PDB
3RNK
Type
protein
Length
216 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Programmed cell death protein 1; Programmed cell death 1 ligand 2
UniProt
Q02242, Q9WUL5
Pockets
1 · best druggability 0.31

Structure

x-ray diffraction · 2 distinct chains · 7% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProgrammed cell death protein 1protein1123% helix, 55% strandQ02242
BProgrammed cell death 1 ligand 2protein10412% helix, 52% strandQ9WUL5

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1600.310.7614empty

Interfaces

1 interface between chains.

  • A–B · 1069 Ų buried · 17 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 3RNK · Crystal structure of the complex between mouse PD-1 mutant and PD-L2 IgV domain · the same entry in another collection · chain A against A, TM-score 1.00
  • Q02242 · AlphaFold monomer V2.0 prediction for programmed cell death protein 1 (Q02242) · a predicted model of the same protein · chain A against A, TM-score 0.95
  • Q9WUL5 · AlphaFold monomer V2.0 prediction for programmed cell death 1 ligand 2 (Q9WUL5) · a predicted model of the same protein · chain B against A, TM-score 0.93

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