Structure of PDB 4pf3 Chain A

Receptor sequence
>4pf3A (length=249) Species: 9606 (Homo sapiens) [Search protein sequence]
TPSPVMVLENIEPEIVYAGYDSSKPDTAENLLSTLNRLAGKQMIQVVKWA
KVLPGFKNLPLEDQITLIQYSWMSLLSFALSWRSYKHTNSQFLYFAPDLV
FNEEKMHQSAMYELCQGMHQISLQFVRLQLTFEEYTIMKVLLLLSTIPKD
GLKSQAAFEEMRTNYIKELRKMVTKCPNNSGQSWQRFYQLTKLLDSMHDL
VSDLLEFCFYTFRESHALKVEFPAMLVEIISDQLPKVESGNVKPLYFHR
3D structure
PDB4pf3 Discovery of 6-[5-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]-benzoxazin-3-one derivatives as novel selective nonsteroidal mineralocorticoid receptor antagonists
ChainA
Resolution1.1 Å
3D
structure
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Enzymatic activity
Enzyme Commision number ?
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 HFN A N770 A773 Q776 M807 L810 F829 M845 M852 L938 F941 C942 T945 N36 A39 Q42 M73 L76 F95 M111 M118 L204 F207 C208 T211 MOAD: ic50=51nM
PDBbind-CN: -logKd/Ki=7.29,IC50=51nM
External links
PDB RCSB:4pf3, PDBe:4pf3, PDBj:4pf3
PDBsum4pf3
PubMed25187277
UniProtP08235|MCR_HUMAN Mineralocorticoid receptor (Gene Name=NR3C2)

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