TRNA-GUANINE TRANSGLYCOSYLASE (TGT) IN COMPLEX WITH 2-AMINO- BENZOGUANINE
PDB id Source Resolution
2Z7K 1.28 angstroms
Ligand Information
Ligand Validity Binding
Data		 Ligand
Warnings		 Eolus Viewer
(click picture
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Viewer		 Molecular
Weight
(Da)		 Formula SMILES
BGU Valid Ki =  77.0 nM   launch gocavviewer-lite   216.199
C9 H8 N6 O
 c1c2c(cc3c1[nH]c(n3)N)N=C(NC2=O)N
GOL Invalid            

CRYSTAL STRUCTURE ANALYSIS AND IN SILICO PKA CALCUL SUGGEST STRONG PKA SHIFTS OF LIGANDS AS DRIVING FOR HIGH-AFFINITY BINDING TO TGT CHEMBIOCHEM V. 10 716 2009

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90% Homology Family

The Class containing this family consists of a total of 2 families.
Leader:    3GE7
TRNA-GUANINE TRANSGLYCOSYLASE IN COMPLEX WITH
6-AMINO-4-{2- [(CYCLOPENTYLMETHYL)AMINO]ETHYL}
-2-(METHYLAMINO)-1,7-DIHYDRI MIDAZO[4,5-G]QUINAZOLIN-8-ONE
PDB id Binding data Representative ligand
3GE7 Ki = 2.0 nM AFQ
1EFZ   PRF
1ENU Ki = 8.3 uM APZ
1F3E Ki = 0.2 uM DPZ
1K4G Ki = 1.4 uM AIQ
1K4H Ki = 7.7 uM APQ
1N2V Ki = 83.0 uM BDI
1OZQ   PRF
1P0B   PQ0
1P0E   PRF
1PXG   PRF
1Q4W Ki = 0.35 uM DQU
1Q63 Ki = 1.4 uM AIQ
1Q65 Ki = 3.5 uM BHB
1Q66 Ki = 1.7 uM KMB
1R5Y Ki = 0.35 uM DQU
1S38 Ki = 7.0 uM MAQ
1S39 Ki = 20.0 nM AQO
1Y5V Ki = 1.0 uM NE8
1Y5W Ki = 6.9 uM NEZ
1Y5X Ki = 3.7 uM E89
2BBF Ki = 7.9 uM 344
2POT   GUN
2PWU   GUN
2PWV   PQ0
2QII   PQ0
2QZR Ki = 55.0 nM S79
2Z1W   BDI
2Z1X   PRF
2Z7K Ki = 77.0 nM BGU
3C2N Ki = 6.0 nM CKR
3C2Y Ki = 1.5 uM S60
3C2Z Ki = 35.0 nM S98
3EOS Ki = 4.0 nM PK2
3EOU Ki = 97.0 nM PK3
3GC4 Ki = 25.0 nM AAQ
3GC5 Ki = 55.0 nM 2MQ