7SR8: PDB entry 7SR8

Molecular mechanism of the the wake-promoting agent TAK-925. Determined by electron microscopy at 3.3 Å resolution. Released 8 Jun 2022.

Method
Electron microscopy
Resolution
3.3 Å
Organism
Homo sapiens
Chains
5
Atoms
9,083
Mol. weight
150.38 kDa
Ligands
OLA, A6F
Released
8 Jun 2022

Explore 7SR8 in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

7SR8 contains 32 α-helices and 66 β-strands across 5 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: 8 helices, 7 β-strands

ElementResiduesLengthSheet
α-helix7-3125
β-strand34-4071
β-strand62-6871
β-strand71-7771
β-strand97-10371
α-helix110-12213
α-helix124-1263
β-strand130-13671
α-helix138-14710
α-helix152-1543
α-helix157-1593
α-helix176-19520
β-strand203-20421
β-strand20711
α-helix216-23419
Chain B: 4 helices, 32 β-strands
ElementResiduesLengthSheet
α-helix3-2523
α-helix30-334
α-helix34-363
α-helix38-392
β-strand47-5152
β-strand58-6363
β-strand69-7463
β-strand78-8363
β-strand88-9473
β-strand100-10564
β-strand111-11664
β-strand120-12564
β-strand134-14074
β-strand146-15275
β-strand156-16165
β-strand165-17065
β-strand176-18165
β-strand18716
β-strand191-19227
β-strand198-20257
β-strand20316
β-strand207-21267
β-strand217-22377
β-strand229-23468
β-strand240-24568
β-strand250-25458
β-strand259-26468
β-strand273-27869
β-strand284-28969
β-strand293-29869
β-strand304-30969
β-strand315110
β-strand32012
β-strand327-32932
β-strand331110
β-strand336-33942
Chain E: 6 helices, 24 β-strands
ElementResiduesLengthSheet
β-strand3-7511
β-strand10-12312
β-strand17-25911
α-helix29-313
β-strand33-40812
β-strand44-51812
β-strand58-60312
α-helix62-643
β-strand68-73611
β-strand78-84711
α-helix88-903
β-strand92-99812
β-strand111112
β-strand115-119512
β-strand140-142313
β-strand146-149414
β-strand155-161713
β-strand166115
β-strand172115
β-strand174-179614
β-strand186-190514
β-strand194-195214
α-helix1961
β-strand203-208613
β-strand211-216613
α-helix221-2233
β-strand226-231614
α-helix2371
β-strand238-239214
β-strand243-247514
Chain G: 2 helices, 0 β-strands
ElementResiduesLengthSheet
α-helix6-2318
α-helix30-4415
Chain R: 12 helices, 3 β-strands
ElementResiduesLengthSheet
α-helix54-8128
α-helix88-11629
β-strand119116
α-helix124-15734
α-helix166-18318
α-helix185-1895
β-strand192-196516
β-strand207-211516
α-helix219-22810
α-helix229-2335
α-helix234-25118
α-helix294-32835
α-helix339-36123
α-helix362-3665
α-helix369-37911

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
a modified Guanine nucleotide-binding protein G(q) subunit alphaAprotein238Homo sapiens
Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1Bprotein340Homo sapiensP62873 (AlphaFold model)
Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2Gprotein82Homo sapiensP59768 (AlphaFold model)
scFv16Eprotein259Homo sapiens
Hypocretin receptor type 2Rprotein407Homo sapiensO43614 (AlphaFold model)
Sequence of entity 1 (A), FASTA
>7SR8_1 a modified Guanine nucleotide-binding protein G(q) subunit alpha (chains A)
MGSTLSAEDKAAVERSKMIDRNLREDGEKARRTLRLLLLGADNSGKSTIVKQMRILHTSG
IFETKFQVDKVNFHMFDVGGQRDERRKWIQCFNDVTAIIFVVDSSDYNRLQEALNDFKSI
WNNRWLRTISVILFLNKQDLLAEKVLAGKSKIEDYFPEFARYTTPEDATPEPGEDPRVTR
AKYFIRKEFVDISTASGDGRHICYPHFTCAVDTENARRIFNDCKDIILQMNLREYNLV
Sequence of entity 2 (B), FASTA
>7SR8_2 Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1 (chains B)
MSELDQLRQEAEQLKNQIRDARKACADATLSQITNNIDPVGRIQMRTRRTLRGHLAKIYA
MHWGTDSRLLVSASQDGKLIIWDSYTTNKVHAIPLRSSWVMTCAYAPSGNYVACGGLDNI
CSIYNLKTREGNVRVSRELAGHTGYLSCCRFLDDNQIVTSSGDTTCALWDIETGQQTTTF
TGHTGDVMSLSLAPDTRLFVSGACDASAKLWDVREGMCRQTFTGHESDINAICFFPNGNA
FATGSDDATCRLFDLRADQELMTYSHDNIICGITSVSFSKSGRLLLAGYDDFNCNVWDAL
KADRAGVLAGHDNRVSCLGVTDDGMAVATGSWDSFLKIWN
Sequence of entity 3 (G), FASTA
>7SR8_3 Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2 (chains G)
MGHHHHHHHHGGASNNTASIAQARKLVEQLKMEANIDRIKVSKAAADLMAYCEAHAKEDP
LLTPVPASENPFREKKFFCAIL
Sequence of entity 4 (E), FASTA
>7SR8_4 scFv16 (chains E)
DVQLVESGGGLVQPGGSRKLSCSASGFAFSSFGMHWVRQAPEKGLEWVAYISSGSGTIYY
ADTVKGRFTISRDDPKNTLFLQMTSLRSEDTAMYYCVRSIYYYGSSPFDFWGQGTTLTVS
SGGGGSGGGGSGGGGSDIVMTQATSSVPVTPGESVSISCRSSKSLLHSNGNTYLYWFLQR
PGQSPQLLIYRMSNLASGVPDRFSGSGSGTAFTLTISRLEAEDVGVYYCMQHLEYPLTFG
AGTKLELKAAAHHHHHHHH
Sequence of entity 5 (R), FASTA
>7SR8_5 Hypocretin receptor type 2 (chains R)
MGTKLEDSPPCRNWSSASELNETQEPFLNPTDYDDEEFLRYLWREYLHPKEYEWVLIAGY
IIVFVVALIGNVLVCVAVWKNHHMRTVTNYFIVNLSLADVLVTITCLPATLVVDITETWF
FGQSLCKVIPYLQTVSVSVSVLTLSCIALDRWYAICHPLMFKSTAKRARNSIVIIWIVSC
IIMIPQAIVMECSTVFPGLANKTTLFTVCDERWGGEIYPKMYHICFFLVTYMAPLCLMVL
AYLQIFRKLWCRQIPGTSSVVQRKWKPLQPVSQPRGPGQPTKSRMSAVAAEIKQIRARRK
TARMLMVVLLVFAICYLPISILNVLKRVFGMFAHTEDRETVYAWFTFSHWLVYANSAANP
IIYNFLSGKFREEFKAAFSCCCLGVHHRQEDRLTRGRTSTESRKSLT

Ligands and cofactors

IDNameFormulaCopies
OLAOleic acidC18 H34 O24
A6Fmethyl (2R,3S)-3-[(methanesulfonyl)amino]-2-({[(1s,4S)-4-phenylcyclohexyl]oxy}m…C21 H32 N2 O5 S1

Primary citation

Molecular mechanism of the wake-promoting agent TAK-925. Yin, J., Kang, Y., McGrath, A.P. et al. Nat Commun (2022) 13:2902-2902. DOI 10.1038/s41467-022-30601-3 · PubMed

Other PDB entries of the same protein (UniProt P62873 (AlphaFold model), which also has an AlphaFold model), best resolution first:

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