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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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Author
Journal/Citation
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PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
UniProtKB/TrEMBL
PubMed
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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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Aldose reductase (AR)
List of PDBs
1DLA
1EF3
1EKO
1EL3
1IEI
1MAR
1PWL
1PWM
1T40
1T41
1US0
1X96
1X97
1X98
1XGD
1Z3N
1Z89
1Z8A
2ACQ
2ACR
2ACS
2ACU
2AGT
2DUX
2DUZ
2DV0
2F2K
2FZ8
2FZ9
2FZB
2FZD
2HV5
2HVN
2HVO
2I16
2I17
2IKG
2IKH
2IKI
2IKJ
2INE
2INZ
2IPW
2IQ0
2IQD
2IS7
2ISF
2J8T
2NVC
2NVD
2PD5
2PD9
2PDB
2PDC
2PDF
2PDG
2PDH
2PDI
2PDJ
2PDK
2PDL
2PDM
2PDN
2PDP
2PDQ
2PDU
2PDW
2PDX
2PDY
2PEV
2PF8
2PFH
2PZN
2QXW
2R24
3BCJ
3DN5
3G5E
3GHR
3GHS
3GHT
3GHU
3LBO
3LD5
3LEN
3LEP
3LQG
3LQL
3LZ3
3LZ5
3M0I
3M4H
3M64
3MB9
3MC5
3ONB
3ONC
3P2V
3Q65
3Q67
3RX2
3RX3
3RX4
3S3G
3T42
3U2C
3V35
3V36
4GCA
4IGS
4JIR
4LAU
4LAZ
4LB3
4LB4
4LBR
4LBS
4NKC
4PR4
4PRR
4PRT
4PUU
4PUW
4Q7B
4QBX
4QR6
4QX4
4QXI
4RPQ
4XZH
4XZI
4YS1
4YU1
5HA7
5OU0
5OUJ
5OUK
6F7R
6F81
6F82
6F84
6F8O
6SYW
6T27
6T3P
6T5G
6T7Q
6TD8
6TUC
6TUF
6TXP
6XUM
6Y03
6Y1P