3QW6A

Crystal structure of the protease domain of botulinum neurotoxin serotype a with a peptide inhibitor rygc
Total Genus 144
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The genus trace: a function that shows values of genus (vertical axis) for subchains spanned between the first residue, and all other residues (shown on horizontal axis). The number of the latter residue and the genus of a given subchain are shown interactively.

Total Genus
144
sequence length
422
structure length
422
Chain Sequence
PFVNKQFNYKDPVNGVDIAYIKIPNAGQMQPVKAFKIHNKIWVIPERDTFTNPEEGDLNPPPEAKQVPVSYYDSTYLSTDNEKDNYLKGVTKLFERIYSTDLGRMLLTSIVRGIPFWGGSTIDTELKVIDTNCINVIQPDGSYRSEELNLVIIGPSADIIQFECKSFGHEVLNLTRNGYGSTQYIRFSPDFTFGFEESLEVDTNPLLGAGKFATDPAVTLAHELIHAGHRLYGIAINPNRVFKVNTNAYYEMSGLEVSFEELRTFGGHDAKFIDSLQENEFRLYYYNKFKDIASTLNKAKSIVGTTASLQYMKNVFKEKYLLSEDTSGKFSVDKLKFDKLYKMLTEIYTEDNFVKFFKVLNRKTYLNFDKAVFKINIVPKVNYTIYDGFNLRNTNLAANFNGQNTEINNMNFTKLKNFTGLF
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The genus matrix. At position (x,y) a genus value for a subchain spanned between x’th and y’th residue is shown. Values of the genus are represented by color, according to the scale given on the right.

Structure visualization

After clicking on a point (x,y) in the genus matrix above, a subchain from x to y is shown in color.

publication title Peptide inhibitors of botulinum neurotoxin serotype A: design, inhibition, cocrystal structures, structure-activity relationship and pharmacophore modeling.
pubmed doi rcsb
molecule tags Hydrolase/hydrolase inhibitor
source organism Clostridium botulinum
molecule keywords Botulinum neurotoxin type A
total genus 144
structure length 422
sequence length 422
ec nomenclature ec 3.4.24.69: Bontoxilysin.
pdb deposition date 2011-02-26
Image from the rcsb pdb (www.rcsb.org)
cath code
ClassArchitectureTopologyHomologyDomain
3.90.1240.10 Alpha Beta Alpha-Beta Complex Zincin-like Metalloproteases ("zincins"), catalytic domain like 3qw6A00
1S0DA 4HEVA 1ZB7A 1S0EA 3V0BB 3FIEA 3FFZA 2G7QA 3BOKA 3BWIA 3C8BA 2ISGA 1YVGA 3V0AA 1G9DA 5BQNA 3C89A 4EJ5A 3QJ0A 3V0AB 2G7NA 2IMAA 2A97A 2W2DA 4EL4A 2G7PA 2ISHA 3QW7A 4ZKTB 3QW8A 2A8AA 4ZJXA 3DSEA 1ZL6A 1S0BA 1G9AA 2IMBA 5BQMA 3NF3A 1T3AA 2ISEA 1F31A 3DEBA 1XTGA 2IMCA 3QW5A 3VUOA 2XHLA 3QW6A 1ZL5A 1F82A 1S0CA 3QIXA 3BOOA 1S0FA 4KUFA 3DDAA 2ETFA 4ELCA 3C8AA 1EPWA 3BONA 4J1LA 2ILPA 3K3QB 1ZKXA 1XTFA 1S0GA 3C88A 4KTXA 1ZKWA 1I1EA 2FPQA 2QN0A 2NP0A 2G7KA 3D3XA 1E1HA 3DDBA 1ZN3A 3ZURA 3DS9A 2NYYA 3FIIA 3ZUQA 1Z7HA 1G9CA 3ZUSA 1T3CA 3BTAA 3QIZA 3V0BA 1G9BA 4KS6A 3QIYA 2NZ9A
chains in the Genus database with same CATH superfamily
1S0DA 4HEVA 1ZB7A 3CQBA 1S0EA 3V0BB 3FIEA 3FFZA 2G7QA 3BOKA 3BWIA 3C8BA 2ISGA 1YVGA 3V0AA 1G9DA 5BQNA 3C89A 4EJ5A 3QJ0A 3V0AB 2G7NA 2IMAA 2A97A 2W2DA 4EL4A 2G7PA 2ISHA 3QW7A 4ZKTB 3QW8A 2A8AA 4ZJXA 3DSEA 1ZL6A 1S0BA 1G9AA 2IMBA 5BQMA 3NF3A 1T3AA 2ISEA 4JIXA 1F31A 3DEBA 1XTGA 2IMCA 3QW5A 3VUOA 2XHLA 3QW6A 1ZL5A 4IL3A 1F82A 1S0CA 3QIXA 3BOOA 1S0FA 2YPTA 4JIUA 4KUFA 3DDAA 2ETFA 4ELCA 3C8AA 1EPWA 3BONA 4J1LA 2ILPA 4QHFA 2EJQA 3K3QB 1ZKXA 1XTFA 1S0GA 3C88A 3E11A 4KTXA 1ZKWA 1I1EA 2FPQA 2QN0A 2NP0A 2G7KA 3D3XA 1E1HA 3DDBA 1ZN3A 3ZURA 4AW6A 3DS9A 2NYYA 3FIIA 3ZUQA 1Z7HA 1G9CA 3ZUSA 1T3CA 3BTAA 3QIZA 3V0BA 1G9BA 4KS6A 3QIYA 2NZ9A
chains in the Genus database with same CATH topology
1S0DA 4HEVA 1ZB7A 1S0EA 3V0BB 3FIEA 3FFZA 2G7QA 3BOKA 3BWIA 3C8BA 2ISGA 1YVGA 3V0AA 1G9DA 5BQNA 3C89A 4EJ5A 3QJ0A 3V0AB 2G7NA 2IMAA 2A97A 2W2DA 4EL4A 2G7PA 2ISHA 3QW7A 4ZKTB 3QW8A 2A8AA 4ZJXA 3DSEA 1ZL6A 1S0BA 1G9AA 2IMBA 5BQMA 3NF3A 1T3AA 2ISEA 1F31A 3DEBA 1XTGA 2IMCA 3QW5A 3VUOA 2XHLA 3QW6A 1ZL5A 1F82A 1S0CA 3QIXA 3BOOA 1S0FA 4KUFA 3DDAA 2ETFA 4ELCA 3C8AA 1EPWA 3BONA 4J1LA 2ILPA 3K3QB 1ZKXA 1XTFA 1S0GA 3C88A 4KTXA 1ZKWA 1I1EA 2FPQA 2QN0A 2NP0A 2G7KA 3D3XA 1E1HA 3DDBA 1ZN3A 3ZURA 3DS9A 2NYYA 3FIIA 3ZUQA 1Z7HA 1G9CA 3ZUSA 1T3CA 3BTAA 3QIZA 3V0BA 1G9BA 4KS6A 3QIYA 2NZ9A
chains in the Genus database with same CATH homology


 
#chains in the Genus database with same CATH superfamily
 1S0D A;  4HEV A;  1ZB7 A;  1S0E A;  3V0B B;  3FIE A;  3FFZ A;  2G7Q A;  3BOK A;  3BWI A;  3C8B A;  2ISG A;  1YVG A;  3V0A A;  1G9D A;  5BQN A;  3C89 A;  4EJ5 A;  3QJ0 A;  3V0A B;  2G7N A;  2IMA A;  2A97 A;  2W2D A;  4EL4 A;  2G7P A;  2ISH A;  3QW7 A;  4ZKT B;  3QW8 A;  2A8A A;  4ZJX A;  3DSE A;  1ZL6 A;  1S0B A;  1G9A A;  2IMB A;  5BQM A;  3NF3 A;  1T3A A;  2ISE A;  1F31 A;  3DEB A;  1XTG A;  2IMC A;  3QW5 A;  3VUO A;  2XHL A;  3QW6 A;  1ZL5 A;  1F82 A;  1S0C A;  3QIX A;  3BOO A;  1S0F A;  4KUF A;  3DDA A;  2ETF A;  4ELC A;  3C8A A;  1EPW A;  3BON A;  4J1L A;  2ILP A;  3K3Q B;  1ZKX A;  1XTF A;  1S0G A;  3C88 A;  4KTX A;  1ZKW A;  1I1E A;  2FPQ A;  2QN0 A;  2NP0 A;  2G7K A;  3D3X A;  1E1H A;  3DDB A;  1ZN3 A;  3ZUR A;  3DS9 A;  2NYY A;  3FII A;  3ZUQ A;  1Z7H A;  1G9C A;  3ZUS A;  1T3C A;  3BTA A;  3QIZ A;  3V0B A;  1G9B A;  4KS6 A;  3QIY A;  2NZ9 A; 
#chains in the Genus database with same CATH topology
 1S0D A;  4HEV A;  1ZB7 A;  3CQB A;  1S0E A;  3V0B B;  3FIE A;  3FFZ A;  2G7Q A;  3BOK A;  3BWI A;  3C8B A;  2ISG A;  1YVG A;  3V0A A;  1G9D A;  5BQN A;  3C89 A;  4EJ5 A;  3QJ0 A;  3V0A B;  2G7N A;  2IMA A;  2A97 A;  2W2D A;  4EL4 A;  2G7P A;  2ISH A;  3QW7 A;  4ZKT B;  3QW8 A;  2A8A A;  4ZJX A;  3DSE A;  1ZL6 A;  1S0B A;  1G9A A;  2IMB A;  5BQM A;  3NF3 A;  1T3A A;  2ISE A;  4JIX A;  1F31 A;  3DEB A;  1XTG A;  2IMC A;  3QW5 A;  3VUO A;  2XHL A;  3QW6 A;  1ZL5 A;  4IL3 A;  1F82 A;  1S0C A;  3QIX A;  3BOO A;  1S0F A;  2YPT A;  4JIU A;  4KUF A;  3DDA A;  2ETF A;  4ELC A;  3C8A A;  1EPW A;  3BON A;  4J1L A;  2ILP A;  4QHF A;  2EJQ A;  3K3Q B;  1ZKX A;  1XTF A;  1S0G A;  3C88 A;  3E11 A;  4KTX A;  1ZKW A;  1I1E A;  2FPQ A;  2QN0 A;  2NP0 A;  2G7K A;  3D3X A;  1E1H A;  3DDB A;  1ZN3 A;  3ZUR A;  4AW6 A;  3DS9 A;  2NYY A;  3FII A;  3ZUQ A;  1Z7H A;  1G9C A;  3ZUS A;  1T3C A;  3BTA A;  3QIZ A;  3V0B A;  1G9B A;  4KS6 A;  3QIY A;  2NZ9 A; 
#chains in the Genus database with same CATH homology
 1S0D A;  4HEV A;  1ZB7 A;  1S0E A;  3V0B B;  3FIE A;  3FFZ A;  2G7Q A;  3BOK A;  3BWI A;  3C8B A;  2ISG A;  1YVG A;  3V0A A;  1G9D A;  5BQN A;  3C89 A;  4EJ5 A;  3QJ0 A;  3V0A B;  2G7N A;  2IMA A;  2A97 A;  2W2D A;  4EL4 A;  2G7P A;  2ISH A;  3QW7 A;  4ZKT B;  3QW8 A;  2A8A A;  4ZJX A;  3DSE A;  1ZL6 A;  1S0B A;  1G9A A;  2IMB A;  5BQM A;  3NF3 A;  1T3A A;  2ISE A;  1F31 A;  3DEB A;  1XTG A;  2IMC A;  3QW5 A;  3VUO A;  2XHL A;  3QW6 A;  1ZL5 A;  1F82 A;  1S0C A;  3QIX A;  3BOO A;  1S0F A;  4KUF A;  3DDA A;  2ETF A;  4ELC A;  3C8A A;  1EPW A;  3BON A;  4J1L A;  2ILP A;  3K3Q B;  1ZKX A;  1XTF A;  1S0G A;  3C88 A;  4KTX A;  1ZKW A;  1I1E A;  2FPQ A;  2QN0 A;  2NP0 A;  2G7K A;  3D3X A;  1E1H A;  3DDB A;  1ZN3 A;  3ZUR A;  3DS9 A;  2NYY A;  3FII A;  3ZUQ A;  1Z7H A;  1G9C A;  3ZUS A;  1T3C A;  3BTA A;  3QIZ A;  3V0B A;  1G9B A;  4KS6 A;  3QIY A;  2NZ9 A; 
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similar chains in the Genus database (?% sequence similarity)
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similar chains in the pdb database (?% sequence similarity)

 
#similar chains in the Genus database (?% sequence similarity)
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#similar chains, but unknotted
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