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7FYK:
Crystal Structure of human FABP4 in complex with 5-phenylmethoxy-4-prop-2-enyl-1,2,4-triazole-3-thiol, i.e. SMILES N1(C(=NN=C1S)OCc1ccccc1)CC=C with IC50=1.3 microM
PDB ID:
7FYK
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MMDB ID:
231360
PDB Deposition Date:
2023/4/27
Updated in MMDB:
2024/12
Experimental Method:
x-ray diffraction
Resolution:
1.12 Å
Source Organism:
Homo sapiens
Similar Structures:
VAST+
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Biological Unit for 7FYK: monomeric; determined by author and by software (PISA)
Molecular Components in 7FYK
Label
Count
Molecule
Protein (1 molecule)
A
1
Fatty Acid-binding Protein, Adipocyte
(Gene symbol:
FABP4
)
Chemicals and Non-standard biopolymers (4 molecules)
1
1
5-(benzyloxy)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
2
2
SULFATE ION
3
1
FORMIC ACID
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH.
"
MMDB and VAST+: tracking structural similarities between macromolecular complexes.
Nucleic Acids Res. 2014 Jan; 42(Database issue)
:D297-303