Structure of PDB 6m0z Chain A Binding Site BS03

Receptor Information
>6m0z Chain A (length=536) Species: 7227 (Drosophila melanogaster) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DERETWSGKVDFLLSVIGFAVDLANVWRFPYLCYKNGGGAFLVPYGIMLA
VGGIPLFYMELALGQHNRKGAITCWGRLVPLFKGIGYAVVLIAFYVGFYY
NVIIAWSLRFFFASFTNSLPWTSCNNIWNTPNCRPFEGHVEGFQSAASEY
FNRYILELNRSEGIHDLGAIKWDMALCLLIVYLICYFSLWKGISTSGKVV
WFTALFPYAVLLILLIRGLTLPGSFLGIQYYLTPNFSAIYKAEVWVDAAT
QVFFSLGPGFGVLLAYASYNKYHNNVYKDALLTSFINSATSFIAGFVIFS
VLGYMAHTLGVRIEDVATEGPGLVFVVYPAAIATMPASTFWALIFFMMLA
TLGLDSSFGGMEAIITALSDEFPKIKRNRELFVAGLFSLYFVVGLASCTQ
GGFYFLHLLDRYAAGYSILVAVFFEAIAVSWIYGTNRFSEDIRDMIGFPP
GRYWQVCWRFVAPIFLLFITVYGLIGYEPLTYADYVYPSWANALGWCIAG
SSVVMIPAVAIFKLLSTPGSLRQRFTILTTPWRDQQ
Ligand information
Ligand IDLNR
InChIInChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1
InChIKeySFLSHLFXELFNJZ-QMMMGPOBSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6c1cc(c(cc1[C@H](CN)O)O)O
CACTVS 3.370NC[CH](O)c1ccc(O)c(O)c1
OpenEye OEToolkits 1.7.6c1cc(c(cc1C(CN)O)O)O
ACDLabs 12.01Oc1ccc(cc1O)C(O)CN
CACTVS 3.370NC[C@H](O)c1ccc(O)c(O)c1
FormulaC8 H11 N O3
NameL-NOREPINEPHRINE;
NORADRENALINE
ChEMBLCHEMBL1437
DrugBankDB00368
ZINCZINC000000057624
PDB chain6m0z Chain A Residue 707 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB6m0z Structural basis of norepinephrine recognition and transport inhibition in neurotransmitter transporters.
Resolution2.88 Å
Binding residue
(original residue number in PDB)		F43 V120 F325 S421 G425
Binding residue
(residue number reindexed from 1)		F19 V96 F260 S356 G360
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Cellular Component
External links
PDB RCSB:6m0z, PDBe:6m0z, PDBj:6m0z
PDBsum6m0z
PubMed33850134
UniProtQ7K4Y6|DAT_DROME Sodium-dependent dopamine transporter (Gene Name=DAT)

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