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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 271 families. | |||||
1 | 3QVL | - | 5HY | C5 H6 N2 O4 | C([C@@H]1C.... |
2 | 3QVK | - | 2AL | C4 H4 N4 O3 | C1(=O)C(=N.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 223 families. | |||||
1 | 3QVL | - | 5HY | C5 H6 N2 O4 | C([C@@H]1C.... |
2 | 3QVK | - | 2AL | C4 H4 N4 O3 | C1(=O)C(=N.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 3AL | 0.9992 |
2 | 2AL | 0.9919 |
3 | DOR | 0.9603 |
4 | 3OC | 0.9545 |
5 | PZI | 0.9530 |
6 | 4CS | 0.9373 |
7 | ASC | 0.9356 |
8 | IT9 | 0.9337 |
9 | ASP | 0.9334 |
10 | MLT | 0.9330 |
11 | AKG | 0.9304 |
12 | LMR | 0.9295 |
13 | EV0 | 0.9272 |
14 | AS3 | 0.9266 |
15 | GLU | 0.9260 |
16 | 2IT | 0.9260 |
17 | P7Y | 0.9234 |
18 | 7N0 | 0.9229 |
19 | DHS | 0.9219 |
20 | ASN | 0.9201 |
21 | OMD | 0.9198 |
22 | ROR | 0.9192 |
23 | 1P3 | 0.9186 |
24 | TMH | 0.9184 |
25 | FP1 | 0.9179 |
26 | ISD | 0.9169 |
27 | PCA | 0.9168 |
28 | 51F | 0.9147 |
29 | KTA | 0.9146 |
30 | TRC | 0.9143 |
31 | 2DR | 0.9139 |
32 | 2FT | 0.9138 |
33 | ISZ | 0.9134 |
34 | 6JN | 0.9133 |
35 | 23J | 0.9133 |
36 | 6CS | 0.9121 |
37 | 261 | 0.9121 |
38 | KP6 | 0.9120 |
39 | BGC | 0.9117 |
40 | LEU | 0.9115 |
41 | OEM | 0.9114 |
42 | 5XB | 0.9112 |
43 | CMS | 0.9105 |
44 | S2G | 0.9103 |
45 | CRN | 0.9103 |
46 | 1LN | 0.9097 |
47 | R2B | 0.9094 |
48 | 92K | 0.9090 |
49 | RB0 | 0.9085 |
50 | B2J | 0.9085 |
51 | NXA | 0.9084 |
52 | FLC | 0.9082 |
53 | UYA | 0.9080 |
54 | DIG | 0.9079 |
55 | PAC | 0.9079 |
56 | XLS | 0.9077 |
57 | SKM | 0.9068 |
58 | 1AB | 0.9065 |
59 | GLN | 0.9063 |
60 | GLL | 0.9061 |
61 | CIT | 0.9059 |
62 | GZQ | 0.9059 |
63 | 2XX | 0.9054 |
64 | TAR | 0.9052 |
65 | S76 | 0.9051 |
66 | IF7 | 0.9050 |
67 | 8EW | 0.9050 |
68 | 4NG | 0.9050 |
69 | OHP | 0.9046 |
70 | TZE | 0.9046 |
71 | IOM | 0.9043 |
72 | RB5 | 0.9042 |
73 | II6 | 0.9040 |
74 | SMN | 0.9039 |
75 | AHR | 0.9039 |
76 | F9P | 0.9039 |
77 | OAA | 0.9036 |
78 | PRZ | 0.9032 |
79 | SHA | 0.9031 |
80 | 2TQ | 0.9029 |
81 | MAH | 0.9027 |
82 | EHM | 0.9023 |
83 | KMH | 0.9017 |
84 | IFL | 0.9017 |
85 | YCP | 0.9016 |
86 | 2PG | 0.9011 |
87 | QY9 | 0.9008 |
88 | KOJ | 0.9006 |
89 | QDK | 0.9004 |
90 | OSE | 0.9000 |
91 | 8GL | 0.8998 |
92 | OIA | 0.8992 |
93 | TLA | 0.8990 |
94 | JZ7 | 0.8989 |
95 | MEV | 0.8987 |
96 | ONL | 0.8981 |
97 | JZ4 | 0.8980 |
98 | GLC | 0.8979 |
99 | NOJ | 0.8978 |
100 | R9S | 0.8977 |
101 | XUL | 0.8977 |
102 | AL0 | 0.8976 |
103 | N7P | 0.8974 |
104 | QUS | 0.8972 |
105 | PRY | 0.8972 |
106 | RBL | 0.8969 |
107 | HIS | 0.8968 |
108 | IXW | 0.8967 |
109 | FOC | 0.8966 |
110 | BSX | 0.8962 |
111 | SRT | 0.8962 |
112 | TAG | 0.8962 |
113 | DGL | 0.8959 |
114 | 263 | 0.8957 |
115 | 5FX | 0.8956 |
116 | 1SA | 0.8955 |
117 | GIF | 0.8953 |
118 | HY1 | 0.8952 |
119 | 449 | 0.8952 |
120 | LCN | 0.8950 |
121 | GLY PRO | 0.8948 |
122 | CNL | 0.8946 |
123 | FA3 | 0.8946 |
124 | SR1 | 0.8945 |
125 | BDF | 0.8942 |
126 | DAS | 0.8942 |
127 | VAH | 0.8942 |
128 | JFJ | 0.8942 |
129 | HY3 | 0.8938 |
130 | C5A | 0.8937 |
131 | GAL | 0.8936 |
132 | PEA | 0.8936 |
133 | 4RW | 0.8933 |
134 | PTO | 0.8932 |
135 | CXF | 0.8931 |
136 | HJP | 0.8931 |
137 | RNS | 0.8930 |
138 | R2P | 0.8930 |
139 | 3HG | 0.8930 |
140 | SC2 | 0.8925 |
141 | HSE | 0.8925 |
142 | IFM | 0.8924 |
143 | MUC | 0.8919 |
144 | TEO | 0.8919 |
145 | 2AS | 0.8917 |
146 | AGK | 0.8915 |
147 | 34V | 0.8911 |
148 | 149 | 0.8909 |
149 | HCI | 0.8907 |
150 | AN0 | 0.8906 |
151 | HL5 | 0.8905 |
152 | LPK | 0.8902 |
153 | PEL | 0.8902 |
154 | CN0 | 0.8900 |
155 | DMJ | 0.8900 |
156 | GZ3 | 0.8899 |
157 | AOS | 0.8895 |
158 | QIC | 0.8895 |
159 | ORN | 0.8894 |
160 | RM1 | 0.8892 |
161 | 6LW | 0.8892 |
162 | DS0 | 0.8891 |
163 | KDF | 0.8891 |
164 | KPL | 0.8889 |
165 | 61M | 0.8888 |
166 | T9G | 0.8885 |
167 | HL4 | 0.8882 |
168 | NCD | 0.8882 |
169 | TNE | 0.8880 |
170 | AIN | 0.8880 |
171 | R1X | 0.8878 |
172 | GCB | 0.8877 |
173 | NFM | 0.8876 |
174 | IMR | 0.8874 |
175 | M6W | 0.8872 |
176 | LNO | 0.8872 |
177 | COI | 0.8871 |
178 | 5AC | 0.8868 |
179 | 3SL | 0.8867 |
180 | PEP | 0.8867 |
181 | CDV | 0.8866 |
182 | 2CL | 0.8864 |
183 | TRA | 0.8862 |
184 | MLE | 0.8861 |
185 | HHT | 0.8860 |
186 | SYG | 0.8859 |
187 | ICF | 0.8859 |
188 | K6H | 0.8857 |
189 | SVD | 0.8856 |
190 | SEP | 0.8853 |
191 | AFR | 0.8848 |
192 | DGN | 0.8847 |
193 | R1P | 0.8847 |
194 | 0OC | 0.8847 |
195 | SF6 | 0.8846 |
196 | GBN | 0.8846 |
197 | NVA | 0.8845 |
198 | HPV | 0.8841 |
199 | UGC | 0.8841 |
200 | GAG | 0.8841 |
201 | MET | 0.8840 |
202 | 7A3 | 0.8838 |
203 | APG | 0.8836 |
204 | PSJ | 0.8835 |
205 | MEQ | 0.8834 |
206 | OTD | 0.8831 |
207 | NIG | 0.8829 |
208 | 98J | 0.8828 |
209 | IPM | 0.8825 |
210 | TLM | 0.8824 |
211 | RUU | 0.8822 |
212 | RNT | 0.8822 |
213 | GYE | 0.8819 |
214 | FA1 | 0.8818 |
215 | AMQ | 0.8815 |
216 | R9M | 0.8811 |
217 | RIB | 0.8807 |
218 | 2LP | 0.8804 |
219 | ILE | 0.8800 |
220 | LDU | 0.8799 |
221 | 7Q1 | 0.8796 |
222 | GLO | 0.8796 |
223 | PEZ | 0.8796 |
224 | 0LH | 0.8795 |
225 | KMT | 0.8793 |
226 | 3HP | 0.8792 |
227 | S2P | 0.8792 |
228 | FRU | 0.8788 |
229 | 271 | 0.8788 |
230 | 7A2 | 0.8786 |
231 | 1AL | 0.8786 |
232 | 7A8 | 0.8785 |
233 | 6FZ | 0.8784 |
234 | NFQ | 0.8783 |
235 | CCB | 0.8783 |
236 | 8S0 | 0.8782 |
237 | 41K | 0.8781 |
238 | PAF | 0.8779 |
239 | Z6J | 0.8778 |
240 | PJL | 0.8777 |
241 | MNM | 0.8776 |
242 | 2EH | 0.8776 |
243 | PPR | 0.8772 |
244 | RMN | 0.8772 |
245 | ICT | 0.8771 |
246 | EPR | 0.8771 |
247 | GCS | 0.8769 |
248 | 13P | 0.8767 |
249 | NLE | 0.8765 |
250 | 7UC | 0.8764 |
251 | MRY | 0.8764 |
252 | QM1 | 0.8763 |
253 | GRO | 0.8761 |
254 | SPV | 0.8761 |
255 | CTS | 0.8759 |
256 | URQ | 0.8757 |
257 | ES6 | 0.8753 |
258 | XBT | 0.8752 |
259 | DPF | 0.8752 |
260 | G3F | 0.8751 |
261 | PRO | 0.8745 |
262 | SDD | 0.8742 |
263 | HA5 | 0.8739 |
264 | QMP | 0.8736 |
265 | BCU | 0.8730 |
266 | AI2 | 0.8729 |
267 | AC5 | 0.8727 |
268 | GZL | 0.8726 |
269 | RAT | 0.8724 |
270 | SJ5 | 0.8724 |
271 | H76 | 0.8722 |
272 | A3M | 0.8718 |
273 | C2A | 0.8712 |
274 | SIN | 0.8708 |
275 | GUA | 0.8703 |
276 | YPN | 0.8703 |
277 | KBG | 0.8701 |
278 | G4D | 0.8698 |
279 | LGC | 0.8696 |
280 | RSF | 0.8695 |
281 | 2HG | 0.8695 |
282 | EDG | 0.8688 |
283 | 49F | 0.8688 |
284 | GNL | 0.8684 |
285 | NSG | 0.8684 |
286 | 47J | 0.8679 |
287 | MFU | 0.8679 |
288 | V6F | 0.8677 |
289 | DTL | 0.8673 |
290 | 7QS | 0.8670 |
291 | HDA | 0.8668 |
292 | GP9 | 0.8664 |
293 | HZP | 0.8663 |
294 | NGW | 0.8661 |
295 | NGT | 0.8661 |
296 | 9RH | 0.8661 |
297 | LYS | 0.8659 |
298 | 8EZ | 0.8657 |
299 | AMC | 0.8654 |
300 | DPR | 0.8648 |
301 | TZL | 0.8644 |
302 | 4VY | 0.8642 |
303 | AH8 | 0.8638 |
304 | BMA | 0.8637 |
305 | 9ON | 0.8633 |
306 | HCS | 0.8630 |
307 | CXP | 0.8629 |
308 | MAE | 0.8629 |
309 | 9SE | 0.8625 |
310 | SKJ | 0.8624 |
311 | G2H | 0.8620 |
312 | 293 | 0.8620 |
313 | M45 | 0.8619 |
314 | OXQ | 0.8618 |
315 | MAN | 0.8617 |
316 | 9X6 | 0.8613 |
317 | HIC | 0.8611 |
318 | DHI | 0.8603 |
319 | 268 | 0.8600 |
320 | SAF | 0.8596 |
321 | PO6 | 0.8590 |
322 | VPR | 0.8555 |
323 | 1DU | 0.8551 |
324 | BFM | 0.8546 |
325 | GBD | 0.8542 |
326 | 4SD | 0.8540 |
327 | ARW | 0.8537 |
328 | LRH | 0.8528 |
This union binding pocket(no: 1) in the query (biounit: 3qvl.bio2) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3qvl.bio2) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 3qvl.bio2) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 3qvl.bio2) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 3qvl.bio2) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 3qvl.bio2) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 7) in the query (biounit: 3qvl.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 8) in the query (biounit: 3qvl.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 9) in the query (biounit: 3qvl.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 10) in the query (biounit: 3qvl.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 11) in the query (biounit: 3qvl.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 12) in the query (biounit: 3qvl.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |