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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 261 families. | |||||
1 | 4RZB | Ki = 30 uM | NFQ | C5 H8 N2 O4 | [H]/N=C/N[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 214 families. | |||||
1 | 4RZB | Ki = 30 uM | NFQ | C5 H8 N2 O4 | [H]/N=C/N[.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | OMD | 0.9540 |
2 | P4B | 0.9471 |
3 | OVM | 0.9464 |
4 | VPR | 0.9456 |
5 | EKN | 0.9454 |
6 | OW4 | 0.9436 |
7 | TRA | 0.9430 |
8 | FLC | 0.9417 |
9 | MLE | 0.9405 |
10 | OVP | 0.9392 |
11 | CIT | 0.9367 |
12 | AN0 | 0.9352 |
13 | 2PG | 0.9346 |
14 | 3MB | 0.9346 |
15 | 1AL | 0.9345 |
16 | PEZ | 0.9344 |
17 | TRC | 0.9326 |
18 | CDT | 0.9322 |
19 | D1X | 0.9322 |
20 | NTM | 0.9322 |
21 | PDC | 0.9303 |
22 | M1E | 0.9303 |
23 | 3HB | 0.9301 |
24 | PHT | 0.9293 |
25 | XSP | 0.9286 |
26 | ORO | 0.9285 |
27 | HQ9 | 0.9278 |
28 | AKH | 0.9274 |
29 | AW5 | 0.9262 |
30 | Q6T | 0.9256 |
31 | 54G | 0.9253 |
32 | OW7 | 0.9243 |
33 | 7VS | 0.9240 |
34 | SC2 | 0.9235 |
35 | M0Q | 0.9230 |
36 | ICT | 0.9229 |
37 | FOT | 0.9227 |
38 | GTQ | 0.9225 |
39 | 4CS | 0.9222 |
40 | DOR | 0.9222 |
41 | V55 | 0.9219 |
42 | VNL | 0.9204 |
43 | C2U | 0.9201 |
44 | M0W | 0.9201 |
45 | AOR | 0.9200 |
46 | CDV | 0.9200 |
47 | HLZ | 0.9200 |
48 | F12 | 0.9195 |
49 | EUG | 0.9190 |
50 | GLY PRO | 0.9185 |
51 | 42C | 0.9181 |
52 | 5MK | 0.9179 |
53 | 2AL | 0.9172 |
54 | 2MN | 0.9164 |
55 | 5RG | 0.9154 |
56 | OXC | 0.9151 |
57 | 3R6 | 0.9151 |
58 | NTC | 0.9151 |
59 | 6CS | 0.9149 |
60 | F0J | 0.9145 |
61 | 0FA | 0.9138 |
62 | CCB | 0.9132 |
63 | 6LW | 0.9131 |
64 | IPM | 0.9130 |
65 | FRU | 0.9128 |
66 | N8P | 0.9128 |
67 | GV9 | 0.9126 |
68 | FPK | 0.9124 |
69 | IPZ | 0.9120 |
70 | NMJ | 0.9109 |
71 | KLW | 0.9101 |
72 | 1P3 | 0.9101 |
73 | DBJ | 0.9097 |
74 | NLQ | 0.9096 |
75 | RIB | 0.9089 |
76 | 34D | 0.9088 |
77 | GLY LEU | 0.9087 |
78 | LMR | 0.9086 |
79 | DIE | 0.9083 |
80 | DHK | 0.9081 |
81 | 9TZ | 0.9081 |
82 | IJZ | 0.9076 |
83 | 5M0 | 0.9076 |
84 | ATH | 0.9073 |
85 | 4AV | 0.9072 |
86 | 12M | 0.9068 |
87 | R9S | 0.9067 |
88 | LEU | 0.9065 |
89 | V6F | 0.9064 |
90 | DIU | 0.9060 |
91 | ASP | 0.9060 |
92 | II6 | 0.9054 |
93 | TEN | 0.9047 |
94 | 3OC | 0.9047 |
95 | 6XI | 0.9046 |
96 | GBN | 0.9042 |
97 | PRZ | 0.9042 |
98 | 3Z7 | 0.9030 |
99 | DIG | 0.9029 |
100 | AME | 0.9027 |
101 | M1H | 0.9024 |
102 | AHR | 0.9024 |
103 | 60Q | 0.9022 |
104 | DBX | 0.9013 |
105 | 4HM | 0.9013 |
106 | ASC | 0.9005 |
107 | AIN | 0.9001 |
108 | 5WY | 0.8999 |
109 | GLY ASP | 0.8996 |
110 | 2TQ | 0.8996 |
111 | R8S | 0.8994 |
112 | 7N0 | 0.8990 |
113 | AH8 | 0.8989 |
114 | RNT | 0.8984 |
115 | OTD | 0.8981 |
116 | HLD | 0.8981 |
117 | HJP | 0.8979 |
118 | PSV | 0.8976 |
119 | KYD | 0.8976 |
120 | ASN | 0.8970 |
121 | SF6 | 0.8968 |
122 | LFR | 0.8965 |
123 | FE DB1 | 0.8964 |
124 | DCO | 0.8962 |
125 | ZZ8 | 0.8961 |
126 | QAT | 0.8961 |
127 | 9KH | 0.8960 |
128 | DPF | 0.8956 |
129 | 1WD | 0.8953 |
130 | DNF | 0.8949 |
131 | 261 | 0.8939 |
132 | BRR | 0.8938 |
133 | JKZ | 0.8933 |
134 | M44 | 0.8931 |
135 | MEV | 0.8930 |
136 | AUD | 0.8928 |
137 | ZZ3 | 0.8920 |
138 | FBU | 0.8920 |
139 | KIB | 0.8919 |
140 | 0CG | 0.8918 |
141 | NQM | 0.8915 |
142 | 4ZC | 0.8915 |
143 | 463 | 0.8914 |
144 | N7P | 0.8913 |
145 | A13 | 0.8912 |
146 | 1U1 | 0.8910 |
147 | AS3 | 0.8909 |
148 | DMO | 0.8907 |
149 | 3AL | 0.8906 |
150 | G2H | 0.8905 |
151 | GM7 | 0.8905 |
152 | HCT | 0.8895 |
153 | DII | 0.8892 |
154 | 2CG | 0.8887 |
155 | 4A5 | 0.8887 |
156 | BDP | 0.8885 |
157 | NLG | 0.8883 |
158 | KBB | 0.8883 |
159 | 2DR | 0.8882 |
160 | 2A7 | 0.8879 |
161 | UNC | 0.8871 |
162 | GYE | 0.8871 |
163 | 1X7 | 0.8870 |
164 | SX1 | 0.8868 |
165 | EV0 | 0.8868 |
166 | 7VJ | 0.8866 |
167 | P22 | 0.8865 |
168 | 1CO | 0.8865 |
169 | 2EH | 0.8853 |
170 | 7NI | 0.8852 |
171 | GCU | 0.8849 |
172 | AQK | 0.8848 |
173 | GLY CYS | 0.8847 |
174 | 8GK | 0.8847 |
175 | 4ME | 0.8842 |
176 | 4M4 | 0.8842 |
177 | S76 | 0.8840 |
178 | 0GZ | 0.8839 |
179 | 7WR | 0.8839 |
180 | MJ2 | 0.8834 |
181 | GJS | 0.8834 |
182 | PEP | 0.8823 |
183 | C2A | 0.8823 |
184 | 791 | 0.8820 |
185 | GOX | 0.8812 |
186 | 8EW | 0.8809 |
187 | SF9 | 0.8801 |
188 | 98J | 0.8800 |
189 | 6JN | 0.8799 |
190 | HMQ | 0.8798 |
191 | GCB | 0.8797 |
192 | HHT | 0.8795 |
193 | GTR | 0.8793 |
194 | EVA | 0.8790 |
195 | MAH | 0.8789 |
196 | 6OT | 0.8786 |
197 | 5HY | 0.8783 |
198 | EYK | 0.8783 |
199 | KIA | 0.8781 |
200 | F69 | 0.8780 |
201 | 1N4 | 0.8779 |
202 | C4L | 0.8778 |
203 | GLY MET | 0.8777 |
204 | XQG | 0.8774 |
205 | RD4 | 0.8772 |
206 | H7Y | 0.8772 |
207 | YQA | 0.8769 |
208 | X1R | 0.8769 |
209 | 5UK | 0.8764 |
210 | MBG | 0.8762 |
211 | ALA LEU | 0.8758 |
212 | 210 | 0.8753 |
213 | DAS | 0.8750 |
214 | XQB | 0.8746 |
215 | CKU | 0.8745 |
216 | 7A3 | 0.8744 |
217 | FA3 | 0.8744 |
218 | TZE | 0.8738 |
219 | B2J | 0.8737 |
220 | XLS | 0.8735 |
221 | AQQ | 0.8731 |
222 | 3S4 | 0.8719 |
223 | IXW | 0.8717 |
224 | 7UC | 0.8714 |
225 | O2A | 0.8714 |
226 | P23 | 0.8695 |
227 | MCO | 0.8692 |
228 | 7A2 | 0.8687 |
229 | 0GY | 0.8683 |
230 | DQA | 0.8680 |
231 | 9PY | 0.8679 |
232 | G88 | 0.8673 |
233 | 1DW | 0.8663 |
234 | 2FG | 0.8658 |
235 | AEH | 0.8646 |
236 | FA6 | 0.8639 |
237 | RBL | 0.8638 |
238 | GTL | 0.8637 |
239 | QM1 | 0.8615 |
240 | KMH | 0.8614 |
241 | QDK | 0.8599 |
242 | SJ5 | 0.8597 |
243 | K2P | 0.8591 |
244 | BCK | 0.8587 |
245 | NXA | 0.8585 |
246 | 3C7 | 0.8578 |
247 | S2T | 0.8576 |
248 | AL0 | 0.8570 |
249 | KP6 | 0.8566 |
250 | SDD | 0.8555 |
251 | 8WQ | 0.8551 |
252 | 3MF | 0.8550 |
253 | ITN | 0.8550 |
254 | FHN | 0.8538 |
255 | 692 | 0.8528 |
This union binding pocket(no: 1) in the query (biounit: 4rzb.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 4rzb.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |