3QW5A

Crystal structure of the protease domain of botulinum neurotoxin serotype a with a peptide inhibitor rrgf
Total Genus 143
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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
143
sequence length
423
structure length
423
Chain Sequence
MPFVNKQFNYKDPVNGVDIAYIKIPNAGQMQPVKAFKIHNKIWVIPERDTFTNPEEGDLNPPPEAKQVPVSYYDSTYLSTDNEKDNYLKGVTKLFERIYSTDLGRMLLTSIVRGIPFWGGSTIDTELKVIDTNCINVIQPDGSYRSEELNLVIIGPSADIIQFECKSFGHEVLNLTRNGYGSTQYIRFSPDFTFGFEESLEVDTNPLLGAGKFATDPAVTLAHELIHAGHRLYGIAINPNRVFKVNTNAYYEMSGLEVSFEELRTFGGHDAKFIDSLQENEFRLYYYNKFKDIASTLNKAKSIVGTTASLQYMKNVFKEKYLLSEDTSGKFSVDKLKFDKLYKMLTEIYTEDNFVKFFKVLNRKTYLNFDKAVFKINIVPKVNYTIYDGFNLRNTNLAANFNGQNTEINNMNFTKLKNFTGLF
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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.

Chord Diagram
S2 (33-39)TVIII1 (2-5)EMPTYTIV1 (15-18)TI1 (9-12)S6 (144-148)O1 (24-26)TIV4 (49-52)TII1 (39-42)S7 (151-155)S3 (42-48)AH1 (81-100)S9 (184-187)S8 (164-167)TI2 (53-56)TIV9 (156-159)TI3 (63-66)TIV7 (64-67)S18 (413-418)TIV8 (68-71)TVIII3 (157-160)TI4 (74-77)TII2 (76-79)TIV12 (189-192)TI13 (381-384)TI14 (385-388)AH2 (102-113)AH4 (217-233)TI5 (123-126)S4 (126-127)AH7 (276-299)S14 (302-303)3H1 (131-133)S5 (134-138)TI6 (139-142)TI8 (174-177)TI9 (175-178)TIV11 (176-179)AH8 (310-321)S10 (192-196)S11 (213-214)AH3 (200-204)TI10 (205-208)TIV15 (365-368)TIV13 (245-248)TII3 (419-422)TI17 (405-408)3H3 (402-404)AH10 (351-358)AH9 (335-348)AH6 (260-266)TI11 (238-241)S12 (242-244)S13 (257-259)AH5 (249-253)TII'1 (267-270)3H2 (270-273)S16 (331-333)TVIII5 (306-309)S15 (323-325)TIV14 (326-329)S17 (372-376)TI12 (380-383)TI15 (386-389)TII'2 (388-391)TIV17 (392-395)TIV16 (389-392)TI16 (395-398)TIV20 (406-409)3H4 (410-412)S1 (19-23)TIV5 (50-53)TI7 (159-162)TIV18 (398-401)Updating...
connected with : NaN
molecule tags Hydrolase/hydrolase inhibitor
source organism Clostridium botulinum
publication title Peptide inhibitors of botulinum neurotoxin serotype A: design, inhibition, cocrystal structures, structure-activity relationship and pharmacophore modeling.
pubmed doi rcsb
molecule keywords Botulinum neurotoxin type A
total genus 143
structure length 423
sequence length 423
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 3qw5A00
2A8AA 2ILPA 2XHLA 3C88A 3BOOA 3BWIA 3QIZA 3C8AA 4ELCA 2IMAA 2QN0A 1F31A 2IMBA 3NF3A 3V0AA 3ZUQA 3FIIA 2FPQA 1S0DA 1S0FA 2ISHA 3FFZA 2W2DA 1XTFA 3QIYA 2NYYA 3ZURA 1ZKWA 2G7NA 3QIXA 3DEBA 2G7PA 3V0AB 2ETFA 2NP0A 3QW7A 3DS9A 1T3AA 3QJ0A 1S0GA 2ISGA 3FIEA 4EJ5A 2A97A 3D3XA 1E1HA 1ZL5A 1YVGA 5BQMA 3BOKA 2NZ9A 1S0CA 1G9AA 4EL4A 4KUFA 4ZKTB 3C89A 1T3CA 1XTGA 3BTAA 3VUOA 3DSEA 3BONA 1ZKXA 1G9CA 3QW8A 4ZJXA 3DDAA 2ISEA 4HEVA 1ZB7A 1Z7HA 2G7KA 2IMCA 1S0EA 1G9DA 1ZN3A 1F82A 1ZL6A 1S0BA 3QW5A 2G7QA 4KTXA 3ZUSA 1I1EA 3V0BB 3C8BA 5BQNA 4J1LA 1EPWA 1G9BA 4KS6A 3QW6A 3DDBA 3K3QB 3V0BA
chains in the Genus database with same CATH superfamily
2A8AA 2ILPA 2XHLA 3C88A 3BOOA 3BWIA 3QIZA 3C8AA 4ELCA 2IMAA 2QN0A 1F31A 2IMBA 3NF3A 3V0AA 3ZUQA 3FIIA 2FPQA 1S0DA 1S0FA 2ISHA 3FFZA 2W2DA 1XTFA 3QIYA 2NYYA 4AW6A 3ZURA 1ZKWA 2G7NA 3QIXA 3DEBA 2G7PA 3V0AB 2YPTA 2ETFA 2NP0A 2EJQA 3QW7A 3DS9A 1T3AA 3QJ0A 1S0GA 2ISGA 3FIEA 4EJ5A 2A97A 3D3XA 1E1HA 1ZL5A 1YVGA 5BQMA 3BOKA 2NZ9A 1S0CA 1G9AA 4IL3A 4EL4A 4KUFA 4ZKTB 3C89A 1T3CA 1XTGA 3BTAA 3VUOA 3DSEA 3BONA 1ZKXA 1G9CA 3QW8A 4ZJXA 3DDAA 2ISEA 4HEVA 1ZB7A 1Z7HA 2G7KA 2IMCA 1S0EA 1G9DA 1ZN3A 1F82A 1ZL6A 1S0BA 3QW5A 2G7QA 4KTXA 4QHFA 3ZUSA 4JIXA 3CQBA 1I1EA 3V0BB 3C8BA 4JIUA 5BQNA 4J1LA 1EPWA 1G9BA 4KS6A 3QW6A 3DDBA 3K3QB 3V0BA 3E11A
chains in the Genus database with same CATH topology
2A8AA 2ILPA 2XHLA 3C88A 3BOOA 3BWIA 3QIZA 3C8AA 4ELCA 2IMAA 2QN0A 1F31A 2IMBA 3NF3A 3V0AA 3ZUQA 3FIIA 2FPQA 1S0DA 1S0FA 2ISHA 3FFZA 2W2DA 1XTFA 3QIYA 2NYYA 3ZURA 1ZKWA 2G7NA 3QIXA 3DEBA 2G7PA 3V0AB 2ETFA 2NP0A 3QW7A 3DS9A 1T3AA 3QJ0A 1S0GA 2ISGA 3FIEA 4EJ5A 2A97A 3D3XA 1E1HA 1ZL5A 1YVGA 5BQMA 3BOKA 2NZ9A 1S0CA 1G9AA 4EL4A 4KUFA 4ZKTB 3C89A 1T3CA 1XTGA 3BTAA 3VUOA 3DSEA 3BONA 1ZKXA 1G9CA 3QW8A 4ZJXA 3DDAA 2ISEA 4HEVA 1ZB7A 1Z7HA 2G7KA 2IMCA 1S0EA 1G9DA 1ZN3A 1F82A 1ZL6A 1S0BA 3QW5A 2G7QA 4KTXA 3ZUSA 1I1EA 3V0BB 3C8BA 5BQNA 4J1LA 1EPWA 1G9BA 4KS6A 3QW6A 3DDBA 3K3QB 3V0BA
chains in the Genus database with same CATH homology


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