5MK7: Botulinum neurotoxin type A

Crystal structure of the receptor-binding domain of botulinum neurotoxin A1 (crystal form 2). Determined by X-ray diffraction at 1.8 Å resolution. Released 28 Mar 2018.

Method
X-ray diffraction
Resolution
1.8 Å
Organism
Clostridium botulinum
Chains
1
Atoms
3,585
Mol. weight
50.71 kDa
Released
28 Mar 2018

Explore 5MK7 in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

5MK7 contains 9 α-helices and 42 β-strands across 1 chain. 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: 9 helices, 42 β-strands

ElementResiduesLengthSheet
α-helix890-8945
β-strand895-90061
β-strand904-90632
β-strand914-91742
β-strand924-92851
α-helix930-9323
β-strand935-93623
β-strand941-94882
α-helix950-9523
α-helix955-9573
β-strand962-96981
β-strand972-97981
β-strand982-98871
β-strand994-100071
β-strand100414
β-strand1015-102172
β-strand1026-103162
β-strand1034-104072
β-strand1047-104823
β-strand1052-105871
β-strand1066-1075102
α-helix1081-109010
β-strand109615
β-strand109816
β-strand110416
α-helix11051
β-strand110617
β-strand1111-111558
β-strand1122-112658
β-strand1133-113758
β-strand1142-114544
β-strand1149-115244
α-helix11581
β-strand1159-116688
β-strand117317
β-strand117515
β-strand1179-118688
β-strand1189-119468
β-strand119519
β-strand1204-120528
β-strand1207-120938
α-helix1211-12133
β-strand121819
β-strand1220-122348
β-strand1235110
β-strand1237-124048
β-strand1246-125498
β-strand1259-126468
α-helix1265-12695
β-strand1281110
β-strand1282-128548

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Botulinum neurotoxin type AAprotein433Clostridium botulinumP0DPI1 (AlphaFold model)
Sequence of entity 1 (A), FASTA
>5MK7_1 Botulinum neurotoxin type A (chains A)
MHHHHHHKNIINTSILNLRYESNHLIDLSRYASKINIGSKVNFDPIDKNQIQLFNLESSK
IEVILKNAIVYNSMYENFSTSFWIRIPKYFNSISLNNEYTIINCMENNSGWKVSLNYGEI
IWTLQDTQEIKQRVVFKYSQMINISDYINRWIFVTITNNRLNNSKIYINGRLIDQKPISN
LGNIHASNNIMFKLDGCRDTHRYIWIKYFNLFDKELNEKEIKDLYDNQSNSGILKDFWGD
YLQYDKPYYMLNLYDPNKYVDVNNVGIRGYMYLKGPRGSVMTTNIYLNSSLYRGTKFIIK
KYASGNKDNIVRNNDRVYINVVVKNKEYRLATNASQAGVEKILSALEIPDVGNLSQVVVM
KSKNDQGITNKCKMNLQDNNGNDIGFIGFHQFNNIAKLVASNWYNRQIERSSRTLGCSWE
FIPVDDGWGERPL

Primary citation

High resolution crystal structures of the receptor-binding domain ofClostridium botulinumneurotoxin serotypes A and FA. Davies, J.R., Hackett, G.S., Liu, S.M. et al. PeerJ (2018) 6:e4552-e4552. DOI 10.7717/peerj.4552 · PubMed

Other PDB entries of the same protein (UniProt P0DPI1 (AlphaFold model), which also has an AlphaFold model), best resolution first:

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