Receptor
PDB id Resolution Class Description Source Keywords
3gc4 1.8 Å EC: 2.4.2.29 TRNA-GUANINE TRANSGLYCOSYLASE IN COMPLEX WITH INHIBITOR ZYMOMONAS MOBILIS DRUG DESIGN TIM BARREL TRNA MODIFICATION GLYCOSYLTRANSFERMETAL-BINDING QUEUOSINE BIOSYNTHESIS TRANSFERASE TRNA PR
Ref.: HOW TO REPLACE THE RESIDUAL SOLVATION SHELL OF POLA SITE RESIDUES TO ACHIEVE NANOMOLAR INHIBITION OF TRNA-GUANINE TRANSGLYCOSYLASE CHEMMEDCHEM V. 4 2012 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data Chemaxon Viewer Molecular Weight (Da) Formula SMILES
AAQ A:395;
Valid;
none;
Ki = 25 nM 363.416 C19 H21 N7 O CNc1[...
GOL A:400;
A:401;
A:402;
A:403;
A:404;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
submit data 92.094 C3 H8 O3 C(C(C...
ZN A:399;
Part of Protein;
none;
submit data 65.409 Zn [Zn+2...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3GE7 1.5 Å EC: 2.4.2.29 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 ZYMOMONAS MOBILIS DRUG DESIGN TGT TIM BARREL GLYCOSYLTRANSFERASE METAL-BINDQUEUOSINE BIOSYNTHESIS TRANSFERASE TRNA PROCESSING
Ref.: HOW TO REPLACE THE RESIDUAL SOLVATION SHELL OF POLA SITE RESIDUES TO ACHIEVE NANOMOLAR INHIBITION OF TRNA-GUANINE TRANSGLYCOSYLASE CHEMMEDCHEM V. 4 2012 2009
Members (52)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1ENU Ki = 8.3 uM APZ C8 H7 N3 O2 c1cc2c(cc1....
2 1Q63 Ki = 1.4 uM AIQ C12 H12 N6 O S c1cnc([nH]....
3 4PUL Kd = 146.1 nM 2WU C10 H10 N6 O CNc1[nH]c2....
4 3GC4 Ki = 25 nM AAQ C19 H21 N7 O CNc1[nH]c2....
5 4LBU Ki = 286 nM 1WJ C18 H24 N6 O5 CNc1[nH]c2....
6 2PWU - GUN C5 H5 N5 O c1[nH]c2c(....
7 2Z1W - BDI C9 H12 N4 O2 CCCCc1[nH]....
8 1K4G Ki = 1.4 uM AIQ C12 H12 N6 O S c1cnc([nH]....
9 1P0E - PRF C7 H9 N5 O c1c(c2c([n....
10 4LEQ Ki = 217 nM 1WK C17 H22 N6 O5 CNc1[nH]c2....
11 4Q4S Kd = 111.6 nM S98 C14 H12 N6 O S c1cc(sc1)C....
12 2QII - PQ0 C7 H5 N5 O c1c(c2c([n....
13 1PXG - PRF C7 H9 N5 O c1c(c2c([n....
14 4KWO Ki = 353 nM 1UD C18 H24 N6 O5 CNc1[nH]c2....
15 1P0B - PQ0 C7 H5 N5 O c1c(c2c([n....
16 2Z7K Ki = 77 nM BGU C9 H8 N6 O c1c2c(cc3c....
17 2POT - GUN C5 H5 N5 O c1[nH]c2c(....
18 3SM0 Ki = 740 nM AEK C18 H24 N6 O CNc1[nH]c2....
19 2QZR Ki = 55 nM S79 C20 H16 N6 O c1ccc2c(c1....
20 4Q4O Kd = 34.3 nM 2YM C16 H21 N7 O c1c2c(cc3c....
21 3S1G Ki = 6500 nM ITE C10 H9 N5 O CNc1[nH]c2....
22 4Q4P Kd = 407.4 nM 2YO C16 H20 N6 O c1c2c(cc3c....
23 4PUM Kd = 188.1 nM 2WU C10 H10 N6 O CNc1[nH]c2....
24 1K4H Ki = 7.7 uM APQ C12 H16 N4 O S CCCSCc1cc(....
25 1EFZ - PRF C7 H9 N5 O c1c(c2c([n....
26 1S38 Ki = 7 uM MAQ C9 H9 N3 O Cc1cccc2c1....
27 1Q65 Ki = 3.5 uM BHB C13 H19 N5 O S CN(C)CCSCc....
28 3EOS Ki = 4 nM PK2 C19 H27 N7 O CNc1[nH]c2....
29 1F3E Ki = 0.2 uM DPZ C8 H8 N4 O2 c1c(cc(c2c....
30 1Y5V Ki = 1 uM NE8 C17 H15 N5 O c1ccc(cc1)....
31 3C2Y Ki = 1.5 uM S60 C10 H9 N5 O Cc1[nH]c2c....
32 1OZQ - PRF C7 H9 N5 O c1c(c2c([n....
33 1Y5X Ki = 3.7 uM E89 C18 H17 N5 O2 COc1ccc(cc....
34 4PUJ Kd = 35 nM CKR C15 H19 N7 O2 c1c2c(cc3c....
35 2BBF Ki = 7.9 uM 344 C9 H7 N5 O c1c2c(cc3c....
36 1R5Y Ki = 0.35 uM DQU C8 H8 N4 O c1cc2c(cc1....
37 3RR4 Ki = 28050 nM HRD C11 H12 N6 O CNc1[nH]c2....
38 3EOU Ki = 97 nM PK3 C12 H14 N6 O2 CNc1[nH]c2....
39 1S39 Ki = 20 nM AQO C8 H7 N3 O c1ccc2c(c1....
40 4Q4Q Kd = 1638.9 nM SAQ C14 H11 N5 O S c1cc(sc1)C....
41 4E2V - PRF C7 H9 N5 O c1c(c2c([n....
42 3TLL Ki = 40830 nM 62D C12 H14 N6 O CCNC1=Nc2c....
43 4PUK Kd = 52.4 nM 2WU C10 H10 N6 O CNc1[nH]c2....
44 2Z1X - PRF C7 H9 N5 O c1c(c2c([n....
45 1Q66 Ki = 1.7 uM KMB C16 H16 N4 O S c1ccc(cc1)....
46 2PWV - PQ0 C7 H5 N5 O c1c(c2c([n....
47 3GC5 Ki = 55 nM 2MQ C12 H15 N7 O CNc1[nH]c2....
48 1N2V Ki = 83 uM BDI C9 H12 N4 O2 CCCCc1[nH]....
49 3GE7 Ki = 2 nM AFQ C18 H25 N7 O CNc1[nH]c2....
50 1Y5W Ki = 6.9 uM NEZ C18 H17 N5 O Cc1ccc(cc1....
51 4Q4R Kd = 369.2 nM SQO C15 H18 N6 O2 c1c2c(cc3c....
52 1Q4W Ki = 0.35 uM DQU C8 H8 N4 O c1cc2c(cc1....
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