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MolNFT v1 · #160793 · protein

Structure of human mait a-F7 TCR in complex with human MR1-2'D-5-op-ru

6PUM: “Structure of human mait a-F7 TCR in complex with human MR1-2'D-5-op-ru”. X-ray diffraction, 2 ligands (Q84, NA). MolNFT v1 #160793 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6PUM
Type
protein
Length
1,615 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q95460, P61769
Ligands
Q84, NA

Structure

x-ray diffraction · 8 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein265—Q95460
B—protein98—P61769
C—protein269—Q95460
D—protein196——
E—protein242——
F—protein99—P61769
G—protein202——
H—protein244——

Ligands and binding sites

  • Q84 · 1,2-dideoxy-1-({2,6-dioxo-5-[(E)-(2-oxopropylidene) amino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-D-erythro-pentitol · ligand · 2 copies · chains A, G, C, D
  • NA · Sodium ion · metal · 4 copies · chains A, B, F, H
  • GOL · Glycerol · additive · 6 copies · chains A, H, C, E, F

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

Compared structures

  • 6PUM · Structure of human MAIT A-F7 TCR in complex with human MR1-2'D-5-OP-RU · the same entry in another collection · chain H against H, TM-score 1.00
  • P61769 · AlphaFold monomer V2.0 prediction for beta-2-microglobulin (P61769) · a predicted model of the same protein · chain B against A, TM-score 0.98

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