5I6X: Ts3 human serotonin transporter

X-ray structure of the ts3 human serotonin transporter complexed with paroxetine at the central site. Determined by X-ray diffraction at 3.14 Å resolution. Released 13 Apr 2016.

Method
X-ray diffraction
Resolution
3.14 Å
Organisms
Homo sapiens, Mus musculus
Chains
3
Atoms
7,631
Mol. weight
110.82 kDa
Ligands
CLR, 8PR, LMT, NAG
Released
13 Apr 2016

Explore 5I6X in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

5I6X contains 52 α-helices and 51 β-strands across 3 chains. Residue ranges use author residue numbering, as in the PDB file, from PDBe. To see them in 3D, choose the Cartoon representation with Secondary structure coloring: helices, sheets and coils get different colors.

Chain A: 42 helices, 8 β-strands

ElementResiduesLengthSheet
α-helix79-802
α-helix85-9612
α-helix99-11113
α-helix114-1174
α-helix118-1236
α-helix124-1296
α-helix130-14314
α-helix149-1524
α-helix156-1594
α-helix160-17314
α-helix176-18813
β-strand20911
β-strand22511
α-helix227-2315
α-helix232-2365
α-helix239-2413
β-strand25112
α-helix253-27018
α-helix274-28411
α-helix287-30014
α-helix306-3138
α-helix317-3215
α-helix323-33715
α-helix343-3497
α-helix358-38932
α-helix396-3983
α-helix403-4042
α-helix405-4095
α-helix410-4156
α-helix420-45334
β-strand45513
β-strand45813
α-helix462-47716
β-strand48212
α-helix485-4917
α-helix492-4965
α-helix497-51014
α-helix511-5155
α-helix518-52811
α-helix532-5343
α-helix535-5395
α-helix540-5445
α-helix545-55814
α-helix560-5623
β-strand56414
β-strand56914
α-helix570-5712
α-helix574-58310
α-helix588-59912
α-helix604-6129
Chain B: 2 helices, 22 β-strands
ElementResiduesLengthSheet
β-strand22-2545
β-strand29-3136
β-strand37-3935
β-strand41-4445
α-helix48-503
β-strand52-5877
β-strand64-7077
β-strand78-7927
β-strand8415
β-strand87-9265
β-strand97-10265
β-strand112-11877
β-strand12717
β-strand12915
β-strand132-13327
β-strand134-13636
β-strand145-14958
β-strand160-170118
β-strand176-17949
β-strand188-19698
β-strand199-209118
α-helix210-2123
β-strand219-22469
β-strand229-23469
Chain C: 8 helices, 21 β-strands
ElementResiduesLengthSheet
β-strand25110
β-strand30-34511
β-strand39-44610
β-strand53-58611
β-strand65-69511
β-strand73-74211
α-helix751
β-strand82-85410
β-strand90-95610
α-helix100-1023
β-strand105-110611
α-helix1161
β-strand118111
β-strand122-127611
β-strand131112
β-strand134-138513
α-helix139-1413
α-helix142-1476
β-strand149-1591113
β-strand160112
β-strand165-169514
β-strand174-175214
β-strand179-183513
α-helix184-1874
β-strand193-2021013
α-helix203-2064
β-strand212-217614
α-helix2241
β-strand225-229514

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Sodium-dependent serotonin transporterAprotein549Homo sapiensP31645 (AlphaFold model)
8B6 antibody, heavy chainBprotein221Mus musculus
8B6 antibody, light chainCprotein214Mus musculus
Sequence of entity 1 (A), FASTA
>5I6X_1 Sodium-dependent serotonin transporter (chains A)
GSQGERETWGKKVDFLLSVIGYAVDLGNVWRFPYICAQNGGGAFLLPYTIMAIFGGIPLF
YMELALGQYHRNGCISIWRKICPIFKGIGYAICIIAFYIASYYNTIMAWALYYLISSFTD
QLPWTSCKNSWNTGNCTNYFSEDNITWTLHSTSPAEEFYTRHVLQIHRSKGLQDLGGISW
QLALCIMLIFTVIYFSIWKGVKTSGKVVWVTATFPYIALSVLLVRGATLPGAWRGVLFYL
KPNWQKLLETGVWIDAAAQIFFSLGPGFGVLLAFASYNKFNNNCYQDALVTSVVNCMTSF
VSGFVIFTVLGYMAEMRNEDVSEVAKDAGPSLLFITYAEAIANMPASTFFAIIFFLMLIT
LGLDSSFAGLEGVITAVLDEFPHVWAKRRERFVLAVVITCFFGSLVTLTFGGAYVVKLLE
EYATGPAVLTVALIEAVAVSWFYGITQFCRDVKEMLGFSPGWFWRICWVAISPLFLLFII
ASFLMSPPQLRLFQYNYPYWSIILGYAIGTSSFICIPTYIAYRLIITPGTFKERIIKSIT
PETPTLVPR
Sequence of entity 2 (B), FASTA
>5I6X_2 8B6 antibody, heavy chain (chains B)
EVQLQQSGPELVKPGASVKISCKASGYTFTDYYMNWVKQSHGKSLEWIGNINPNNGGTSY
NQKFKGKATLTVDKSSTTAYMELRSLTSEDSAVYYCTRSPVRPYYFDYWGQGTTLTVSSA
KTTPPSVYPLAPGCGDTTGSSVTLGCLVKGYFPESVTVTWNSGSLSSSVHTFPALLQSGL
YTMSSSVTVPSSTWPSQTVTCSVAHPASSTTVDKKLEPSGP
Sequence of entity 3 (C), FASTA
>5I6X_3 8B6 antibody, light chain (chains C)
DIVMTQSHKFMSTSVGDRVSITCKASQDVSTAVAWYQQKPGQSPKLLIYSASYRYTGVPD
RFTGSGSGTDFTFTISSVQAEDLAVYYCQQHYSIPRTFGGGTKLEIKRADAAPTVSIFPP
SSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLT
LTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC

Ligands and cofactors

IDNameFormulaCopies
CLRCholesterolC27 H46 O1
8PRParoxetineC19 H20 F N O31
LMTDodecyl-beta-D-maltosideC24 H46 O111
NAG2-acetamido-2-deoxy-beta-D-glucopyranoseC8 H15 N O62

Water and common crystallization additives (NA, CL) are not listed.

Primary citation

X-ray structures and mechanism of the human serotonin transporter. Coleman, J.A., Green, E.M., Gouaux, E. Nature (2016) 532:334-339. DOI 10.1038/nature17629 · PubMed

Other PDB entries of the same protein (UniProt P31645 (AlphaFold model), which also has an AlphaFold model), best resolution first:

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