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MolNFT v1 · #55268 · protein

Complex of a B21 chicken MHC class I molecule and a 10MER chicken peptide

2YEZ · Major histocompatibility complex class I glycoprotein…: “Complex of a B21 chicken MHC class I molecule and a 10MER chicken peptide”. X-ray diffraction, 2 pockets (best druggability 0.67). MolNFT v1 #55268 on GenesisL1: 3D structure…

PDB
2YEZ
Type
protein
Length
384 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Major histocompatibility complex class I glycoprotein haplotype B21…
UniProt
Q95601, P21611, Q5ZMD1
Pockets
2 · best druggability 0.67

Structure

x-ray diffraction · 3 distinct chains · 22% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMajor histocompatibility complex class I glycoprotein haplotype B21protein27828% helix, 38% strandQ95601
BBeta-2-microglobulinprotein960% helix, 50% strandP21611
C14-3-3 protein thetaprotein1040% helix, 0% strandQ5ZMD1

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15260.670.7861empty
2640.310.7514empty

Interfaces

2 interfaces between chains.

  • A–B · 1632 Ų buried · 17 hydrogen bonds · protein-protein
  • A–C · 940 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 2YEZ · Complex of a B21 chicken MHC class I molecule and a 10MER chicken peptide · the same entry in another collection · chain A against A, TM-score 1.00
  • P21611 · AlphaFold monomer V2.0 prediction for beta-2-microglobulin (P21611) · a predicted model of the same protein · chain B against A, TM-score 0.95
  • Q5ZMD1 · AlphaFold monomer V2.0 prediction for 14-3-3 protein theta (Q5ZMD1) · a predicted model of the same protein · chain C against A, TM-score 0.42

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