2A65

Crystal structure of LEUTAA, a bacterial homolog of Na+/Cl--dependent neurotransmitter transporters

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Functional Information from GO Data

ChainGOidnamespacecontents
A0016021cellular_componentintegral component of membrane
A0005886cellular_componentplasma membrane
A0005328molecular_functionneurotransmitter:sodium symporter activity
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Functional Information from PDB Data

site_idNumber of ResiduesDetails
AC110BINDING SITE FOR RESIDUE BOG A 701
ChainResidue
ALEU53
AARG142
AGLU146
APRO445
AARG446
ATYR448
AHOH837
AHOH876
AHOH932
AHOH941

AC27BINDING SITE FOR RESIDUE BOG A 702
ChainResidue
ALEU166
APHE167
AILE170
AARG438
AGLY439
AGLY440
AHOH928

AC38BINDING SITE FOR RESIDUE BOG A 703
ChainResidue
APRO164
ALEU166
ATYR169
AHIS391
APHE395
ABOG704
AHOH884
AHOH1006

AC49BINDING SITE FOR RESIDUE BOG A 704
ChainResidue
ALYS163
AHIS391
ALEU392
APHE395
ATRP484
APHE488
ABOG703
ABOG705
AHOH972

AC513BINDING SITE FOR RESIDUE BOG A 705
ChainResidue
AILE161
APHE395
ALYS431
AMET476
AGLU477
AGLU478
ATHR479
ATRP481
AVAL483
ATRP484
AILE485
AARG487
ABOG704

AC66BINDING SITE FOR RESIDUE NA A 751
ChainResidue
AGLY20
AVAL23
AGLY24
AALA351
ATHR354
ASER355

AC75BINDING SITE FOR RESIDUE NA A 752
ChainResidue
AALA22
AASN27
ATHR254
AASN286
ALEU601

AC82BINDING SITE FOR RESIDUE CL A 753
ChainResidue
ATYR151
ASER165

AC912BINDING SITE FOR RESIDUE LEU A 601
ChainResidue
AASN21
AALA22
AGLY24
ALEU25
AGLY26
AASN27
ATYR108
APHE253
ATHR254
ASER256
APHE259
ANA752

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Functional Information from PDB atom coordinates for the "HETATM" binding sites

site_idNumber of ResiduesDetails
LEU_2a65_A_60117LEUCINE binding site
ChainResidueligand
AASN21-ASN27LEU: LEUCINE
AVAL104LEU: LEUCINE
ATYR108LEU: LEUCINE
APHE253-SER256LEU: LEUCINE
APHE259LEU: LEUCINE
AASN286LEU: LEUCINE
ASER355LEU: LEUCINE
AILE359LEU: LEUCINE

BOG_2a65_A_7017B-OCTYLGLUCOSIDE binding site
ChainResidueligand
ALEU52-LEU53BOG: B-OCTYLGLUCOSIDE
APRO445-TYR448BOG: B-OCTYLGLUCOSIDE
AVAL451BOG: B-OCTYLGLUCOSIDE

BOG_2a65_A_7025B-OCTYLGLUCOSIDE binding site
ChainResidueligand
AILE120BOG: B-OCTYLGLUCOSIDE
ALEU166-PHE167BOG: B-OCTYLGLUCOSIDE
AILE170BOG: B-OCTYLGLUCOSIDE
AILE174BOG: B-OCTYLGLUCOSIDE

BOG_2a65_A_7055B-OCTYLGLUCOSIDE binding site
ChainResidueligand
AILE161BOG: B-OCTYLGLUCOSIDE
ALEU392BOG: B-OCTYLGLUCOSIDE
APHE395-LEU396BOG: B-OCTYLGLUCOSIDE
AILE485BOG: B-OCTYLGLUCOSIDE

BOG_2a65_A_7046B-OCTYLGLUCOSIDE binding site
ChainResidueligand
ALEU162-PRO164BOG: B-OCTYLGLUCOSIDE
AHIS391-LEU392BOG: B-OCTYLGLUCOSIDE
APHE395BOG: B-OCTYLGLUCOSIDE

BOG_2a65_A_7039B-OCTYLGLUCOSIDE binding site
ChainResidueligand
ALYS163-LEU166BOG: B-OCTYLGLUCOSIDE
ATYR169BOG: B-OCTYLGLUCOSIDE
APHE387-PHE388BOG: B-OCTYLGLUCOSIDE
AHIS391BOG: B-OCTYLGLUCOSIDE
APHE395BOG: B-OCTYLGLUCOSIDE

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Functional Information from PROSITE/UniProt

site_idNumber of ResiduesDetails
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Functional Information from SwissProt/UniProt

site_idNumber of ResiduesDetails
SWS_FT_FI14Imipramine 1.
ChainResidueDetails
ALEU25
ATYR107
AILE111
APHE253

SWS_FT_FI22Imipramine 2.
ChainResidueDetails
AARG185
APHE350

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Catalytic Information from CSA

site_idNumber of ResiduesDetails