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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
pH (Enzymatic Assay)
pH (ITC)
Substrate or Competitor
Compound Mol. Wt.
Chemical Structure
Pathways
Source Organism
Number of Compounds
Monomer List in csv
Het List in SDF
Compound
FDA Drugs
Important Compounds
Chemical Structure
Name
SMILES
Number of Data
/
Targets
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Journal/Citation
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PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
UniProtKB/TrEMBL
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All Compounds & Data
Target Names &
Ki
IC50
Kd
EC50
ΔG°
ΔH°
-TΔS°
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Deposition
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rcsb
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Catechol-O-methyltransferase
List of PDBs
1H1D
1JR4
1VID
2CL5
2ZLB
2ZTH
2ZVJ
3A7D
3HVH
3HVI
3HVJ
3HVK
3NW9
3NWB
3NWE
3OE4
3OE5
3OZR
3OZS
3OZT
3R6T
3S68
3U81
4P58
4P7F
4P7G
4P7J
4P7K
4PYL
4PYM
4PYN
4PYO
4PYQ
5FHQ
5FHR
5K01
5K03
5K05
5K09
5K0B
5K0C
5K0E
5K0F
5K0G
5K0J
5K0L
5K0N
5LQA
5LQC
5LQJ
5LQK
5LQN
5LQR
5LQU
5LR6
5P8W
5P8X
5P8Y
5P8Z
5P90
5P91
5P92
5P93
5P94
5P95
5P96
5P97
5P98
5P99
5P9A
5P9B
5P9C
5P9D
5P9E
5P9N
5P9O
5P9P
5P9Q
5P9R
5P9S
5P9T
5P9U
5P9V
5P9W
5P9X
5P9Y
5P9Z
5PA0
5PA1
5PA2
5PA3
5PA4
5PA5
5PA6
5PA7
6AW4
6AW5
6AW6
6AW7
6AW8
6AW9
6GY1
6LFE