Structure of PDB 5el2 Chain B Binding Site BS02

Receptor Information
>5el2 Chain B (length=125) Species: 7165 (Anopheles gambiae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DTTPRRDAEYPPPELLEALKPLHDICLGKTGVTEEAIKKFSDEEIHEDEK
LKCYMNCLFHEAKVVDDNGDVHLEKLHDSLPSSMHDIAMHMGKRCLYPEG
ETLCDKAFWLHKCWKQSDPKHYFLV
Ligand information
Ligand IDKBR
InChIInChI=1S/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3/t10-,11+/m1/s1
InChIKeyQLHULAHOXSSASE-MNOVXSKESA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.4CCC(C)OC(=O)N1CCCCC1CCO
CACTVS 3.385
OpenEye OEToolkits 2.0.4		CC[C@@H](C)OC(=O)N1CCCC[C@H]1CCO
CACTVS 3.385CC[CH](C)OC(=O)N1CCCC[CH]1CCO
FormulaC12 H23 N O3
NameIcaridin;
Picaridin;
Bayrepel;
KBR 3023
ChEMBL
DrugBank
ZINCZINC000005922359
PDB chain5el2 Chain B Residue 202 [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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PDB5el2 The crystal structure of the AgamOBP1Icaridin complex reveals alternative binding modes and stereo-selective repellent recognition.
Resolution1.75 Å
Binding residue
(original residue number in PDB)		L19 L58 F59 A62 F123 V125
Binding residue
(residue number reindexed from 1)		L19 L58 F59 A62 F123 V125
Annotation score1
Binding affinityPDBbind-CN: -logKd/Ki=4.47,Kd=0.034mM
Gene Ontology
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UnboundLocalError		Python 3.6.8: /usr/bin/python3
Sun Nov 24 19:30:53 2024

A problem occurred in a Python script. Here is the sequence of function calls leading up to the error, in the order they occurred.

 /var/www/html/BioLiP/pdb.cgi in <module>()
   1435     title=pdb2title(pdbid)
   1436     if bs.startswith("BS"):
=> 1437         pubmed,uniprot=display_interaction(pdbid,asym_id,bs,title)
   1438     else:
   1439         if lig3:
pubmed = '', uniprot = '', display_interaction = <function display_interaction>, pdbid = '5el2', asym_id = 'B', bs = 'BS02', title = 'The crystal structure of the AgamOBP1Icaridin co...modes and stereo-selective repellent recognition.'
 /var/www/html/BioLiP/pdb.cgi in display_interaction(pdbid='5el2', asym_id='B', bs='BS02', title='The crystal structure of the AgamOBP1Icaridin co...modes and stereo-selective repellent recognition.')
   1295         display_ec(ec,csaOrig,csaRenu)
   1296     if go:
=> 1297         display_go(go,uniprot,pdbid,asym_id)
   1298     return pubmed,uniprot
   1299 
global display_go = <function display_go>, go = '0005549', uniprot = '', pdbid = '5el2', asym_id = 'B'
 /var/www/html/BioLiP/pdb.cgi in display_go(go='0005549', uniprot='', pdbid='5el2', asym_id='B')
    480         '''.replace("$namespace_link",namespace_link
    481           ).replace("$namespace",namespace
=>  482           ).replace("$uniprot",u
    483         ))
    484         for l,(term,name) in enumerate(go2aspect[Aspect]):
u undefined

UnboundLocalError: local variable 'u' referenced before assignment
      args = ("local variable 'u' referenced before assignment",)
      with_traceback = <built-in method with_traceback of UnboundLocalError object>