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EBI is an Outstation of the European Molecular Biology Laboratory.
IntEnz
Integrated relational Enzyme database
5 January 2023
Enzymes
• Enzymes are proteins that catalyze chemical reactions.
• Very important as many processes in biological cells
need enzymes....
• As there are many enzymes in the world, a classification
system was invented to help identify and name them...
IntEnz
5 January 2023
2
NC-IUBMB
• In the 1950’s the increasing amounts of known enzymes
were causing confusion. No official nomenclature system
for enzymes.
• The IUBMB created the International Commission on
Enzymes in 1956 to deal with enzyme nomenclature
• Later replaced with the Nomenclature Committee of the
International Union of Biochemistry and Molecular
Biology (NC-IUBMB)
IntEnz
5 January 2023
3
EC Numbers
• NC-IUBMB developed the Enzyme Classification number
system (EC)
• Classification system is based on the reactions the
enzymes catalyzed
• Classification:
 Classes
 Subclasses
 Sub-subclasses
 EC numbers (Enzyme Commission)
• Example EC 1.1.1.1
IntEnz
5 January 2023
4
EC Classification - Classes
EC 1 – Oxidoreductases; catalyze oxidation/reduction reactions.
EC 2 – Transferases; transfer a functional group e.g. Methyl group.
EC 3 – Hydrolases; catalyse the hydrolysis of various bonds.
EC 4 – Lyases; cleave various bonds by means other than
hydrolysis and oxidation
EC 5 – Isomerases; catalyse changes within one molecule.
EC 6 – Ligases; joining of two molecules with concomitant
hydrolysis of the diphosphate bond in ATP or a similar
triphosphate.
IntEnz
5 January 2023
5
IntEnz
5 January 2023
6
EC numbers lifecycle
New
Suggested
Proposed
Accepted
Rejected
Deleted
Transferred
Public
Private
IntEnz (www.ebi.ac.uk/intenz)
IntEnz
5 January 2023
7
IntEnz
5 January 2023
8
What's in IntEnz
• Official Enzyme nomenclature from NC-IUBMB
• Data from ENZYME database (SIB)
 Cofactors
 Extra cross references: UniProtKB/Swiss-Prot, Prosite
• Extra cross references: CSA, GO
• Enzyme spotlights
• Two different views of the same data:
 IntEnz
 ENZYME
IntEnz
5 January 2023
9
The (official) enzyme nomenclature
• Classification:
 Classes
 Subclasses
 Sub-subclasses
 EC numbers (Enzyme Commission)
• Nomenclature
• Reactions (as plain text)
• Comments
• Cross references: BRENDA, EXPASY, KEGG, ERGO, PDB,
CAS registry
• Bibliographic references
Maintained by NC-IUBMB
IntEnz Entry
IntEnz
5 January 2023
Classification
system
Accepted
Name
Reaction
(Rhea)
Cofactor
(ChEBI)
10
IntEnz entry continued
IntEnz
5 January 2023
Citations
UniProt Links
11
Simple Search Example
IntEnz
5 January 2023
12
IntEnz
5 January 2023
13
Simple search
• Search by EC number:
 1.1.1.1
 1.2.3.12
 1.13.1.13
• Search by compound:
 Caffeine
 CoA
• Search by enzyme name:
 Oxalate oxidase
 Agarase
 3/4 collagenase
• Search by cross-reference:
 Q42884
 GO:0047948
Advanced Search Example
IntEnz
5 January 2023
14
IntEnz
5 January 2023
15
Advanced search
• Search by reaction participant:
 CoA
 CoA-SH
 CoASH
 Coenzyme-A
• Search by cofactor:
 CoA
 magnesium manganese (any)
 magnesium manganese (both)
IntEnz
5 January 2023
16
Browsing IntEnz
• Browse the whole classification from the home page
Browsing via Enzyme entry
IntEnz
5 January 2023
• Browse upwards from an enzyme entry
17
IntEnz
5 January 2023
18
Downloading IntEnz
• IntEnzXML
• Individual enzymes/all of them
• ASCII format/XChars-enhanced format
• XSD available
• Query/format using XSLT
• enzyme.dat file
 Generated from IntEnz for SIB
• BioPAX level 2
 A standard exchange format for biological pathway data
 Based in OWL (semantic web)
Rafael Alcántara (Developer, EBI)
Kristian Axelsen (Curator, SIB)
Paula de Matos (Coordinator, EBI)
Anne Morgat (Curator, SIB)
Christoph Steinbeck (Team leader, EBI)
http://www.ebi.ac.uk/intenz
ftp://ftp.ebi.ac.uk/pub/databases/intenz
http://sourceforge.net/projects/intenz
intenz-help@lists.sourceforge.net
IntEnz team and resources
IntEnz
5 January 2023
19
IntEnz
5 January 2023
20
Exercises!
http://www.ebi.ac.uk/intenz

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Enzyme classification

  • 1. EBI is an Outstation of the European Molecular Biology Laboratory. IntEnz Integrated relational Enzyme database 5 January 2023
  • 2. Enzymes • Enzymes are proteins that catalyze chemical reactions. • Very important as many processes in biological cells need enzymes.... • As there are many enzymes in the world, a classification system was invented to help identify and name them... IntEnz 5 January 2023 2
  • 3. NC-IUBMB • In the 1950’s the increasing amounts of known enzymes were causing confusion. No official nomenclature system for enzymes. • The IUBMB created the International Commission on Enzymes in 1956 to deal with enzyme nomenclature • Later replaced with the Nomenclature Committee of the International Union of Biochemistry and Molecular Biology (NC-IUBMB) IntEnz 5 January 2023 3
  • 4. EC Numbers • NC-IUBMB developed the Enzyme Classification number system (EC) • Classification system is based on the reactions the enzymes catalyzed • Classification:  Classes  Subclasses  Sub-subclasses  EC numbers (Enzyme Commission) • Example EC 1.1.1.1 IntEnz 5 January 2023 4
  • 5. EC Classification - Classes EC 1 – Oxidoreductases; catalyze oxidation/reduction reactions. EC 2 – Transferases; transfer a functional group e.g. Methyl group. EC 3 – Hydrolases; catalyse the hydrolysis of various bonds. EC 4 – Lyases; cleave various bonds by means other than hydrolysis and oxidation EC 5 – Isomerases; catalyse changes within one molecule. EC 6 – Ligases; joining of two molecules with concomitant hydrolysis of the diphosphate bond in ATP or a similar triphosphate. IntEnz 5 January 2023 5
  • 6. IntEnz 5 January 2023 6 EC numbers lifecycle New Suggested Proposed Accepted Rejected Deleted Transferred Public Private
  • 8. IntEnz 5 January 2023 8 What's in IntEnz • Official Enzyme nomenclature from NC-IUBMB • Data from ENZYME database (SIB)  Cofactors  Extra cross references: UniProtKB/Swiss-Prot, Prosite • Extra cross references: CSA, GO • Enzyme spotlights • Two different views of the same data:  IntEnz  ENZYME
  • 9. IntEnz 5 January 2023 9 The (official) enzyme nomenclature • Classification:  Classes  Subclasses  Sub-subclasses  EC numbers (Enzyme Commission) • Nomenclature • Reactions (as plain text) • Comments • Cross references: BRENDA, EXPASY, KEGG, ERGO, PDB, CAS registry • Bibliographic references Maintained by NC-IUBMB
  • 10. IntEnz Entry IntEnz 5 January 2023 Classification system Accepted Name Reaction (Rhea) Cofactor (ChEBI) 10
  • 11. IntEnz entry continued IntEnz 5 January 2023 Citations UniProt Links 11
  • 13. IntEnz 5 January 2023 13 Simple search • Search by EC number:  1.1.1.1  1.2.3.12  1.13.1.13 • Search by compound:  Caffeine  CoA • Search by enzyme name:  Oxalate oxidase  Agarase  3/4 collagenase • Search by cross-reference:  Q42884  GO:0047948
  • 15. IntEnz 5 January 2023 15 Advanced search • Search by reaction participant:  CoA  CoA-SH  CoASH  Coenzyme-A • Search by cofactor:  CoA  magnesium manganese (any)  magnesium manganese (both)
  • 16. IntEnz 5 January 2023 16 Browsing IntEnz • Browse the whole classification from the home page
  • 17. Browsing via Enzyme entry IntEnz 5 January 2023 • Browse upwards from an enzyme entry 17
  • 18. IntEnz 5 January 2023 18 Downloading IntEnz • IntEnzXML • Individual enzymes/all of them • ASCII format/XChars-enhanced format • XSD available • Query/format using XSLT • enzyme.dat file  Generated from IntEnz for SIB • BioPAX level 2  A standard exchange format for biological pathway data  Based in OWL (semantic web)
  • 19. Rafael Alcántara (Developer, EBI) Kristian Axelsen (Curator, SIB) Paula de Matos (Coordinator, EBI) Anne Morgat (Curator, SIB) Christoph Steinbeck (Team leader, EBI) http://www.ebi.ac.uk/intenz ftp://ftp.ebi.ac.uk/pub/databases/intenz http://sourceforge.net/projects/intenz intenz-help@lists.sourceforge.net IntEnz team and resources IntEnz 5 January 2023 19

Editor's Notes

  1. Each enzyme is allocated a four-digit EC number, the first three digits of which define the reaction catalysed and the fourth of which is a unique identifier (serial number). Each enzyme is also assigned a systematic name that uniquely defines the reaction catalysed.
  2. Six main classes into which all enzymes are classified.
  3. IntEnz is a database focussed exclusively on Enzyme Nomenclature.
  4. Accepted NC-IUBMB name