Receptor
PDB id Resolution Class Description Source Keywords
3JUC 1.2 Å EC: 2.3.2.4 HUMAN GAMMA-GLUTAMYLAMINE CYCLOTRANSFERASE COMPLEX WITH 5- OXOPROLINE HOMO SAPIENS CYCLOTRANSFERASE GAMMA-GLUTAMYLAMINE CYCLOTRANSFERASE GAMMA-GLUTAMYL-EPSILON-LYSINE EPSILON-(GAMMA-GLUTAMYL)- LYSINE OXOPROLINE 5-OXO-L-PROLINE CYCLOTRANSFERASE FOLDTRANSFERASE
Ref.: IDENTIFICATION AND CHARACTERIZATION OF {GAMMA}-GLUTAMYLAMINE CYCLOTRANSFERASE: AN ENZYME RESPONSIBLE FOR {GAMMA}-GLUTAMYL-{EPSILON}-LYSINE CATABOLISM J.BIOL.CHEM. V. 285 9642 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NO3 A:154;
A:155;
Invalid;
Invalid;
none;
none;
submit data
62.005 N O3 [N+](...
PCA A:1001;
Valid;
none;
submit data
129.114 C5 H7 N O3 C1CC(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3JUC 1.2 Å EC: 2.3.2.4 HUMAN GAMMA-GLUTAMYLAMINE CYCLOTRANSFERASE COMPLEX WITH 5- OXOPROLINE HOMO SAPIENS CYCLOTRANSFERASE GAMMA-GLUTAMYLAMINE CYCLOTRANSFERASE GAMMA-GLUTAMYL-EPSILON-LYSINE EPSILON-(GAMMA-GLUTAMYL)- LYSINE OXOPROLINE 5-OXO-L-PROLINE CYCLOTRANSFERASE FOLDTRANSFERASE
Ref.: IDENTIFICATION AND CHARACTERIZATION OF {GAMMA}-GLUTAMYLAMINE CYCLOTRANSFERASE: AN ENZYME RESPONSIBLE FOR {GAMMA}-GLUTAMYL-{EPSILON}-LYSINE CATABOLISM J.BIOL.CHEM. V. 285 9642 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3JUC - PCA C5 H7 N O3 C1CC(=O)N[....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3JUC - PCA C5 H7 N O3 C1CC(=O)N[....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3JUC - PCA C5 H7 N O3 C1CC(=O)N[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: PCA; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 PCA 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3JUC; Ligand: PCA; Similar sites found: 186
This union binding pocket(no: 1) in the query (biounit: 3juc.bio1) has 11 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1MJH ATP 0.001828 0.47495 None
2 1G16 GDP 0.002042 0.47114 None
3 4MN7 SME 0.003252 0.44668 None
4 4CO3 ATP 0.007968 0.44477 None
5 1D4O NAP 0.01105 0.42789 None
6 3I54 CMP 0.00777 0.42566 None
7 1JAY NAP 0.0135 0.42439 None
8 3I59 N6R 0.01108 0.42048 None
9 2PN6 GLN 0.01658 0.40825 None
10 3I59 N6S 0.01954 0.40691 None
11 3R5W F42 0.0236 0.4066 None
12 1LK7 DER 0.01632 0.40631 None
13 4PL9 ADP 0.01698 0.40437 None
14 1RLJ FMN 0.02306 0.40326 None
15 4BX7 B4F 0.04761 0.40196 None
16 4K6B GLU 0.01129 0.40144 None
17 3MB5 SAM 0.02687 0.40385 1.30719
18 3HGM ATP 0.008109 0.43245 1.36054
19 4FE2 AIR 0.01888 0.40089 1.56863
20 5F7R GLC GLC 0.02097 0.411 1.96078
21 4EDK GTP 0.01692 0.40575 1.96078
22 1QMG APX 0.003272 0.44894 2.61438
23 4R6W PC 0.03862 0.42863 2.61438
24 1G3M PCQ 0.0297 0.42011 2.61438
25 3I5C C2E 0.006428 0.41784 2.61438
26 2C94 TSF 0.03896 0.41295 2.61438
27 3LU1 NAD 0.04699 0.40453 2.61438
28 3QV1 NAD 0.02835 0.40422 2.61438
29 1V8B NAD 0.04796 0.40326 2.61438
30 2Q1W NAD 0.003679 0.46855 3.26797
31 1RPN NDP 0.01639 0.4236 3.26797
32 1J49 NAD 0.01908 0.4171 3.26797
33 1HKU NAD 0.0295 0.41421 3.26797
34 1J0D 5PA 0.02885 0.4095 3.26797
35 3JZ4 NAP 0.03939 0.40541 3.26797
36 1CF2 NAP 0.04422 0.40291 3.26797
37 1LQA NDP 0.04619 0.40244 3.26797
38 4M69 ANP 0.002856 0.45252 3.92157
39 2WPF FAD 0.02255 0.45159 3.92157
40 2WPF WPF 0.0229 0.45159 3.92157
41 3VPH NAD 0.02487 0.42164 3.92157
42 3QJ4 FAD 0.02725 0.41905 3.92157
43 1YY5 FAD 0.03127 0.41815 3.92157
44 2QZS GLC 0.0497 0.41813 3.92157
45 1V59 FAD 0.03779 0.41678 3.92157
46 4WB6 ATP 0.01952 0.41386 3.92157
47 2WZM NA7 0.02077 0.40969 3.92157
48 2JHP SAH 0.01218 0.4095 3.92157
49 3ZLB ANP 0.02107 0.40846 3.92157
50 2CDU ADP 0.01516 0.40606 3.92157
51 1RQL VSO 0.01463 0.4059 3.92157
52 4G1V FAD 0.03704 0.40522 3.92157
53 4M3P HCS 0.0227 0.40459 3.92157
54 2C91 NAP 0.04444 0.40181 3.92157
55 2BH9 NAP 0.02396 0.40072 3.92157
56 4MCC 21X 0.04392 0.40569 4.47154
57 3FMI KAP 0.005665 0.44703 4.57516
58 4XDZ NDP 0.006752 0.43957 4.57516
59 5E4R NAP 0.008291 0.43791 4.57516
60 2VVL FAD 0.01679 0.4365 4.57516
61 2ZIF SAM 0.007801 0.43385 4.57516
62 2VVM FAD 0.01893 0.43294 4.57516
63 2F59 INI 0.008613 0.43032 4.57516
64 3GD4 FAD 0.01901 0.42634 4.57516
65 5MW4 5JU 0.03352 0.41685 4.57516
66 2IXB NAD 0.03037 0.41493 4.57516
67 2IXB A2G 0.04091 0.41447 4.57516
68 3GD4 NAD 0.01918 0.41312 4.57516
69 3ZKK XYP XYP XYP XYP 0.03493 0.41295 4.57516
70 5LYH 7B8 0.03059 0.41043 4.57516
71 3FHI ANP 0.02314 0.40957 4.57516
72 3GDN FAD 0.04806 0.40866 4.57516
73 2C29 NAP 0.04613 0.40646 4.57516
74 3AKK ADP 0.02629 0.40044 4.57516
75 1M4I PAP 0.008627 0.45293 5.22876
76 1M4I KAN 0.008627 0.45293 5.22876
77 1M4I COA 0.008627 0.45293 5.22876
78 4J7H TRH 0.005198 0.43607 5.22876
79 4WZ8 3W7 0.01778 0.43173 5.22876
80 2Q0L FAD 0.02404 0.42997 5.22876
81 4KQ6 DLZ 0.006957 0.42714 5.22876
82 4LY9 1YY 0.04237 0.42543 5.22876
83 3ETG GTP 0.04209 0.41991 5.22876
84 3KDN CAP 0.04034 0.41676 5.22876
85 3IA4 NDP 0.04059 0.40607 5.22876
86 5H86 BCO 0.03568 0.40154 5.22876
87 2I0K FAD 0.0427 0.40029 5.22876
88 5HWK BEZ 0.0000005563 0.58676 5.88235
89 4AT0 FAD 0.01986 0.43613 5.88235
90 2NVK FAD 0.0196 0.43081 5.88235
91 1HSK FAD 0.02342 0.42485 5.88235
92 4C3Y ANB 0.04772 0.41546 5.88235
93 2QZZ EMF 0.04264 0.41356 5.88235
94 2QZZ NAP 0.04115 0.41356 5.88235
95 4EDF UPG 0.04326 0.41107 5.88235
96 1NE6 SP1 0.0207 0.40996 5.88235
97 4FJU NAI 0.04408 0.40406 5.88235
98 4UP3 NDP 0.03001 0.40177 5.88235
99 5KJZ PCG 0.02258 0.40578 6
100 1MO9 KPC 0.02127 0.45729 6.53595
101 1MO9 FAD 0.01953 0.45612 6.53595
102 4HA9 NDP 0.008238 0.42791 6.53595
103 1FFU CDP 0.02515 0.42375 6.53595
104 4KQW NAP 0.01857 0.42171 6.53595
105 3QVV 3QV 0.03595 0.41092 6.53595
106 3QVV A3P 0.03743 0.41092 6.53595
107 4F07 FAD 0.0176 0.40829 6.53595
108 2B6N ALA PRO THR 0.001928 0.40725 6.53595
109 2GRU NAD 0.03715 0.40563 6.53595
110 2EIX FAD 0.03701 0.40297 6.53595
111 5KBF CMP 0.0192 0.40141 6.53595
112 2GCG NDP 0.04643 0.40066 6.53595
113 4MUV PCG 0.02155 0.40866 7.04225
114 4TM3 FAD 0.01117 0.46648 7.18954
115 1M5B BN1 0.01911 0.45692 7.18954
116 1VDC FAD 0.009275 0.45484 7.18954
117 1RM0 D6P 0.01007 0.45256 7.18954
118 4KGD TDP 0.03948 0.43655 7.18954
119 4KGD FAD 0.04025 0.43655 7.18954
120 3EB9 FLC 0.009333 0.43321 7.18954
121 4JDR FAD 0.01971 0.42199 7.18954
122 2FXU ATP 0.04502 0.42001 7.18954
123 1Q20 PLO 0.02443 0.41939 7.18954
124 3OEN GLU 0.006738 0.41706 7.18954
125 3RG9 WRA 0.02958 0.41619 7.18954
126 2IVN ANP 0.02281 0.416 7.18954
127 1EJB INJ 0.01664 0.41517 7.18954
128 5BW4 SAM 0.01105 0.41326 7.18954
129 4BLW SAH 0.01995 0.41268 7.18954
130 3RG9 NDP 0.02899 0.41204 7.18954
131 1RC0 KT5 0.03361 0.40542 7.18954
132 2Q28 TPP 0.02789 0.40318 7.18954
133 2G86 UMP 0.04049 0.42204 7.84314
134 2BHZ MAL 0.02889 0.41647 7.84314
135 1H9A NAP 0.0294 0.41231 7.84314
136 2X1L ADN 0.01816 0.41089 7.84314
137 4AVB CMP 0.0244 0.40007 7.84314
138 1P31 EPU 0.005588 0.44005 8.49673
139 4M52 FAD 0.0152 0.43038 8.49673
140 4XB2 HSE 0.01857 0.42773 8.49673
141 4XB2 NDP 0.01216 0.42773 8.49673
142 1P3D UMA 0.01399 0.42606 8.49673
143 3I6I NDP 0.02543 0.42359 8.49673
144 2A8X FAD 0.03476 0.40785 8.49673
145 4XOI GTP 0.02124 0.40717 8.49673
146 3OTI TYD 0.0273 0.40593 8.49673
147 4X1T UDP 0.007264 0.43076 9.15033
148 1NE7 AGP 0.01958 0.40934 9.15033
149 3A4T SFG 0.02627 0.40386 9.15033
150 2ZSC BTN 0.01593 0.40316 9.21986
151 2IHU TP9 0.0139 0.43806 9.80392
152 2YVJ FAD 0.01852 0.43155 9.80392
153 2PZM NAD 0.02624 0.42578 9.80392
154 2PZM UDP 0.02624 0.42578 9.80392
155 3KJS DQ1 0.02351 0.42257 9.80392
156 3KJS NAP 0.01485 0.42257 9.80392
157 3GFS FMN 0.01038 0.42019 9.80392
158 4TSK NDP 0.0207 0.41915 9.80392
159 1KRH FAD 0.01515 0.41757 9.80392
160 1YBH P22 0.005886 0.4299 10.4575
161 3MQ2 SAH 0.01372 0.40708 10.4575
162 4PNE SAH 0.03178 0.40177 10.4575
163 4FBL SPD 0.01689 0.40248 11.1111
164 5U5G NAP 0.02921 0.41016 11.7647
165 2W2X GSP 0.02504 0.40446 11.7647
166 2E1A MSE 0.007969 0.42031 12
167 1WDK NAD 0.02118 0.41967 12.4183
168 5GRF ADP 0.02767 0.41472 13.0719
169 3SQP FAD 0.02928 0.46498 13.7255
170 3TKA SAM 0.01259 0.41872 15.6863
171 4J56 FAD 0.04492 0.41367 15.7895
172 3ZSN MIV 0.03768 0.41154 16.3399
173 3EUT DCR 0.0184 0.42101 16.9935
174 1KOR ARG 0.03242 0.43525 17.6471
175 1KOR ANP 0.03294 0.43525 17.6471
176 1KOR SIN 0.03242 0.43525 17.6471
177 2ZXI FAD 0.03236 0.4226 17.6471
178 3IBH GSH 0.02642 0.40109 17.6471
179 3S5W FAD 0.03006 0.41488 18.3007
180 4CYD CMP 0.01407 0.41062 19.0476
181 4JB1 FAD 0.01845 0.44043 19.6078
182 4JB1 NAP 0.01792 0.44043 19.6078
183 4DHY GLC 0.0324 0.40794 19.6078
184 2VQD AP2 0.0185 0.41047 21.5686
185 3WMX NAD 0.03814 0.40298 24.8366
186 4K39 SAM 0.02333 0.40392 44.4444
Feedback