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8JWY

Crystal structure of A2AR-T4L in complex with 2-118

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A
(A)
Adenosine receptor A2a,Endolysinpolymer48154059.01UniProt (P29274)
UniProt (D9IEF7)
Pfam (PF00001)
Pfam (PF00959)
Homo sapiens (human)
2B
(A)
3-[2-azanyl-6-[2-oxidanylidene-1-[[6-(2-oxidanylpropan-2-yl)pyridin-2-yl]methyl]pyridin-4-yl]pyrimidin-4-yl]-2-methyl-benzenecarbonitrilenon-polymer452.51Chemie (VBF)
3C
(A)
CHOLESTEROLnon-polymer386.71Chemie (CLR)
4D, E, F, G, H...
(A)
OLEIC ACIDnon-polymer282.518Chemie (OLA)
5L
(A)
SODIUM IONnon-polymer23.01Chemie (NA)
6T
(A)
(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoatenon-polymer356.51Chemie (OLC)
7X
(A)
waterwater18.0207Chemie (HOH)
Sequence modifications
A: 2 - 208 (UniProt: P29274)
PDBExternal DatabaseDetails
Asp -7-expression tag
Tyr -6-expression tag
Lys -5-expression tag
Asp -4-expression tag
Asp -3-expression tag
Asp -2-expression tag
Asp -1-expression tag
Gly 0-expression tag
Ala 1-expression tag
A: 209 - 368 (UniProt: D9IEF7)
PDBExternal DatabaseDetails
Thr 261Cys 54engineered mutation
Ala 304Cys 97engineered mutation
A: 369 - 463 (UniProt: P29274)
PDBExternal DatabaseDetails
His 464-expression tag
His 465-expression tag
His 466-expression tag
His 467-expression tag
His 468-expression tag
His 469-expression tag
His 470-expression tag
His 471-expression tag
His 472-expression tag
His 473-expression tag
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains1
Total formula weight54059.0
Non-Polymers*Number of molecules22
Total formula weight6303.0
All*Total formula weight60361.9
*Water molecules are not included.

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PDB entries from 2024-11-06

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