3V0B

3.9 angstrom crystal structure of BoNT/Ai in complex with NTNHA

Summary for 3V0B

DescriptorBoNT/A, NTNH, ZINC ION, ... (4 entities in total)
Functional Keywordsvhh free inlocked complex, botulinum neurotoxin, toxin
Biological sourceClostridium botulinum
Total number of polymer chains2
Total molecular weight288005.58
Authors
Gu, S.,Rumpel, S.,Zhou, J.,Strotmeier, J.,Bigalke, H.,Perry, K.,Shoemaker, C.B.,Rummel, A.,Jin, R. (deposition date: 2011-12-07, release date: 2012-03-14, Last modification date: 2013-09-25)
Primary citation
Gu, S.,Rumpel, S.,Zhou, J.,Strotmeier, J.,Bigalke, H.,Perry, K.,Shoemaker, C.B.,Rummel, A.,Jin, R.
Botulinum neurotoxin is shielded by NTNHA in an interlocked complex.
Science, 335:977-981, 2012
PubMed: 22363010 (PDB entries with the same primary citation)
DOI: 10.1126/science.1214270
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (3.9 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.276100.0%4.7%6.3%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 3v0b
no rotation
Molmil generated image of 3v0b
rotated about x axis by 90°
Molmil generated image of 3v0b
rotated about y axis by 90°