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4XQA

CRYSTAL STRUCTURE OF AD37 FIBER KNOB IN COMPLEX WITH TRIVALENT SIALIC ACID INHIBITOR ME0462

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, B, C
(A, B, C)
Fiberpolymer19421716.53UniProt (Q64823)
Pfam (PF00541)
Human adenovirus 37Fiber protein
2D, F, H, J
(A, B, C)
ACETATE IONnon-polymer59.04Chemie (ACT)
3E, I, K
(A, B, C)
ZINC IONnon-polymer65.43Chemie (ZN)
4G
(B)
(1-{2-[bis(2-{4-[({(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranonosyl}oxy)methyl]-1H-1,2,3-triazol-1-yl}ethyl)amino]ethyl}-1H-1,2,3-triazol-4-yl)methyl (6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-beta-L-threo-hex-2-ulopyranosidonic acidnon-polymer1266.21Chemie (423)
5L, M, N
(A, B, C)
waterwater18.0540Chemie (HOH)
Sequence modifications
A, B, C: 177 - 365 (UniProt: Q64823)
PDBExternal DatabaseDetails
Gly 172-expression tag
Ala 173-expression tag
Met 174-expression tag
Gly 175-expression tag
Ser 176-expression tag
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains3
Total formula weight65149.6
Non-Polymers*Number of molecules8
Total formula weight1698.6
All*Total formula weight66848.2
*Water molecules are not included.

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PDB entries from 2025-06-18

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