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8SVT

Crystal structure of pregnane X receptor ligand binding domain in complex with SJPYT-331

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, BNuclear receptor subfamily 1 group I member 2, Nuclear receptor coactivator 1 fusion protein,Nuclear receptor coactivator 1polymer35139895.62UniProt (O75469)
UniProt (Q15788)
Pfam (PF00104)
Pfam (PF08832)
In PDB
Homo sapiens (human)Orphan nuclear receptor PAR1,Orphan nuclear receptor PXR,Pregnane X receptor,Steroid and xenobiotic receptor,SXR,NCoA-1,Class E basic helix-loop-helix protein 74,bHLHe74,Protein Hin-2,RIP160,Renal carcinoma antigen NY-REN-52,Steroid receptor coactivator 1,SRC-1
2A, Bmethyl 3-{[(1P)-1-(2,5-dimethoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carbonyl]amino}-4-{[(3S)-hexan-3-yl]oxy}benzoatenon-polymer496.62Chemie (WU6)
3ADIMETHYL SULFOXIDEnon-polymer78.11Chemie (DMS)
4waterwater18.078Chemie (HOH)
Sequence modifications
A, B: 130 - 434 (UniProt: O75469)
PDBExternal DatabaseDetails
His 123-expression tag
His 124-expression tag
His 125-expression tag
His 126-expression tag
His 127-expression tag
His 128-expression tag
Gly 129-expression tag
Ser 435-linker
Gly 436-linker
Gly 437-linker
Ser 438-linker
Gly 439-linker
Gly 440-linker
A, B: 441 - 473 (UniProt: Q15788)
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains2
Total formula weight79791.3
Non-Polymers*Number of molecules3
Total formula weight1071.2
All*Total formula weight80862.5
*Water molecules are not included.

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PDB entries from 2024-06-26

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