3Q8F: 2-Fluorohistine labeled Protective Antigen

Crystal structure of 2-Fluorohistine labeled Protective Antigen (pH 5.8). Determined by X-ray diffraction at 2.1 Å resolution. Released 15 Feb 2012.

Method
X-ray diffraction
Resolution
2.1 Å
Organism
Bacillus anthracis
Chains
1
Atoms
5,204
Mol. weight
83.42 kDa
Ligands
CA
Released
15 Feb 2012

Explore 3Q8F in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

3Q8F contains 22 α-helices and 57 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: 22 helices, 57 β-strands

ElementResiduesLengthSheet
β-strand19-2461
β-strand32-3871
β-strand4212
β-strand4513
α-helix47-493
β-strand5914
β-strand62-6981
β-strand75-7735
β-strand87-9151
β-strand95-9731
β-strand106-10835
β-strand114-12181
β-strand12914
β-strand13013
β-strand13312
β-strand135-13736
β-strand143-14536
β-strand151-15221
α-helix185-1906
β-strand192-19651
β-strand201-20551
β-strand21911
α-helix235-2406
α-helix249-2524
β-strand25617
β-strand262-273128
β-strand288-29258
β-strand293-29759
β-strand328-33479
α-helix346-3494
β-strand357-368128
β-strand374110
α-helix378-3803
β-strand381-38559
β-strand389-39469
β-strand405110
β-strand409-41138
α-helix417-4182
β-strand419-42028
α-helix429-4313
β-strand433-43538
α-helix436-44510
β-strand447-45269
β-strand458-463611
β-strand468-476911
α-helix477-48711
β-strand488-49367
β-strand501-50667
β-strand508112
α-helix513-5153
α-helix519-5202
β-strand521-522213
α-helix523-5319
β-strand534114
β-strand541-542214
β-strand545-546214
α-helix547-5493
β-strand550-55457
α-helix556-56813
α-helix574-5807
α-helix5811
β-strand582-583213
β-strand584112
β-strand588-59367
β-strand596-598315
β-strand604-607415
α-helix609-6146
β-strand619-623516
β-strand626-629416
α-helix633-6375
β-strand639-647917
β-strand653-655317
β-strand666-668316
β-strand674-677416
α-helix685-6873
β-strand695-702817
α-helix703-7053
β-strand724-730717
α-helix731-7333

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Protective antigenAprotein735Bacillus anthracisP13423 (AlphaFold model)
Sequence of entity 1 (A), FASTA
>3Q8F_1 Protective antigen (chains A)
EVKQENRLLNESESSSQGLLGYYFSDLNFQAPMVVTSSTTGDLSIPSSELENIPSENQYF
QSAIWSGFIKVKKSDEYTFATSADNHVTMWVDDQEVINKASNSNKIRLEKGRLYQIKIQY
QRENPTEKGLDFKLYWTDSQNKKEVISSDNLQLPELKQKSSNSRKKRSTSAGPTVPDRDN
DGIPDSLEVEGYTVDVKNKRTFLSPWISNIHEKKGLTKYKSSPEKWSTASDPYSDFEKVT
GRIDKNVSPEARHPLVAAYPIVHVDMENIILSKNEDQSTQNTDSQTRTISKNTSTSRTHT
SEVHGNAEVHASFFDIGGSVSAGFSNSNSSTVAIDHSLSLAGERTWAETMGLNTADTARL
NANIRYVNTGTAPIYNVLPTTSLVLGKNQTLATIKAKENQLSQILAPNNYYPSKNLAPIA
LNAQDDFSSTPITMNYNQFLELEKTKQLRLDTDQVYGNIATYNFENGRVRVDTGSNWSEV
LPQIQETTARIIFNGKDLNLVERRIAAVNPSDPLETTKPDMTLKEALKIAFGFNEPNGNL
QYQGKDITEFDFNFDQQTSQNIKNQLAELNATNIYTVLDKIKLNAKMNILIRDKRFHYDR
NNIAVGADESVVKEAHREVINSSTEGLLLNIDKDIRKILSGYIVEIEDTEGLKEVINDRY
DMLNISSLRQDGKTFIDFKKYNDKLPLYISNPNYKVNVYAVTKENTIINPSENGDTSTNG
IKKILIFSKKGYEIG

Ligands and cofactors

IDNameFormulaCopies
CACalcium ionCa2

Water and common crystallization additives (PG4) are not listed.

Primary citation

pH effects on binding between the anthrax protective antigen and the host cellular receptor CMG2. Rajapaksha, M., Lovell, S., Janowiak, B.E. et al. Protein Sci (2012) 21:1467-1480. DOI 10.1002/pro.2136 · PubMed

Other PDB entries of the same protein (UniProt P13423 (AlphaFold model), which also has an AlphaFold model), best resolution first:

Browse structure collections

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