Structure of PDB 9eub Chain B

Receptor sequence
>9eubB (length=124) Species: 9606 (Homo sapiens) [Search protein sequence]
GAPATVTEQGEDITSKKDRGVLKIVKRVGNGEETPMIGDKVYVHYKGKLS
NGKKFDSSHPFVFSLGKGQVIKAWDIGVATMKKGEIAHLLIKPEYAYGSA
GSLPKIPSNATLFFEIELLDFKGE
3D structure
PDB9eub 1,4-Pyrazolyl-containing SAFit-analogues are selective FKBP51 inhibitors with improved ligand efficiency and drug-like profile.
ChainB
Resolution2.0 Å
3D
structure
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Enzymatic activity
Enzyme Commision number 5.2.1.8: peptidylprolyl isomerase.
Interaction with ligand
Site
#
Ligand Ligand
chain
Binding residues on receptor
(original residue number in PDB)
Binding residues on receptor
(residue number reindexed from 1)
Binding affinity
BS01 A1H7E B Y57 D68 F77 Q85 V86 W90 Y113 S118 I122 F130 Y45 D56 F61 Q69 V70 W74 Y97 S102 I106 F114
External links
PDB RCSB:9eub, PDBe:9eub, PDBj:9eub
PDBsum9eub
PubMed38818693
UniProtQ13451|FKBP5_HUMAN Peptidyl-prolyl cis-trans isomerase FKBP5 (Gene Name=FKBP5)

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