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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 2 families. | |||||
1 | 4PXE | - | GLV | C2 H2 O3 | C(=O)C(=O).... |
2 | 4PXC | - | HGY | C2 H5 N O3 | [C@H](C(=O.... |
3 | 4PXB | - | UGC | C3 H6 N2 O4 | [C@H](C(=O.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 4PXE | - | GLV | C2 H2 O3 | C(=O)C(=O).... |
2 | 4PXC | - | HGY | C2 H5 N O3 | [C@H](C(=O.... |
3 | 4PXB | - | UGC | C3 H6 N2 O4 | [C@H](C(=O.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | OXL | 1.0000 |
2 | 5Y9 | 1.0000 |
3 | HBR | 1.0000 |
4 | HBS | 1.0000 |
5 | ALQ | 1.0000 |
6 | NAK | 1.0000 |
7 | NIS | 1.0000 |
8 | BUO | 1.0000 |
9 | PYM | 1.0000 |
10 | 2OP | 1.0000 |
11 | OXD | 1.0000 |
12 | PYR | 1.0000 |
13 | LAC | 1.0000 |
14 | 03W | 0.9904 |
15 | DGY | 0.9904 |
16 | HIU | 0.9875 |
17 | TF4 | 0.9847 |
18 | AOA | 0.9782 |
19 | 1AC | 0.9740 |
20 | C2N | 0.9734 |
21 | KG7 | 0.9724 |
22 | 3OH | 0.9707 |
23 | DXX | 0.9701 |
24 | 2KT | 0.9696 |
25 | FAH | 0.9689 |
26 | GLV | 0.9671 |
27 | BUQ | 0.9669 |
28 | PPI | 0.9664 |
29 | MB3 | 0.9664 |
30 | GLY | 0.9660 |
31 | SAR | 0.9658 |
32 | DCY | 0.9656 |
33 | GOA | 0.9651 |
34 | DE2 | 0.9648 |
35 | BAL | 0.9642 |
36 | AGU | 0.9631 |
37 | HAE | 0.9630 |
38 | 3PY | 0.9620 |
39 | F50 | 0.9616 |
40 | SER | 0.9607 |
41 | AKR | 0.9597 |
42 | 3MT | 0.9593 |
43 | KSW | 0.9592 |
44 | B20 | 0.9587 |
45 | NIE | 0.9586 |
46 | BNZ | 0.9585 |
47 | HVB | 0.9581 |
48 | 0PY | 0.9580 |
49 | BAQ | 0.9577 |
50 | 3ZS | 0.9573 |
51 | DMI | 0.9570 |
52 | ALF | 0.9562 |
53 | BU4 | 0.9560 |
54 | GBL | 0.9542 |
55 | F3V | 0.9539 |
56 | P1R | 0.9534 |
57 | DTI | 0.9523 |
58 | NHY | 0.9522 |
59 | PHZ | 0.9517 |
60 | MMZ | 0.9515 |
61 | AMT | 0.9508 |
62 | DSN | 0.9500 |
63 | CYS | 0.9498 |
64 | 4AX | 0.9486 |
65 | 3TR | 0.9485 |
66 | BUA | 0.9484 |
67 | HSL | 0.9476 |
68 | 3BB | 0.9476 |
69 | 2AI | 0.9473 |
70 | GOL | 0.9467 |
71 | TAY | 0.9463 |
72 | MGX | 0.9463 |
73 | MLA | 0.9462 |
74 | 1CB | 0.9459 |
75 | HOW | 0.9453 |
76 | GXV | 0.9451 |
77 | 3HR | 0.9450 |
78 | PPF | 0.9447 |
79 | NMU | 0.9445 |
80 | ATQ | 0.9443 |
81 | 61G | 0.9442 |
82 | 2A3 | 0.9438 |
83 | 6SP | 0.9431 |
84 | 1MZ | 0.9426 |
85 | 4MZ | 0.9426 |
86 | TSZ | 0.9423 |
87 | HUI | 0.9421 |
88 | MR3 | 0.9421 |
89 | C5J | 0.9419 |
90 | IPH | 0.9412 |
91 | HLT | 0.9410 |
92 | BRP | 0.9408 |
93 | HYN | 0.9403 |
94 | 2MZ | 0.9397 |
95 | 9A4 | 0.9395 |
96 | MLI | 0.9393 |
97 | R3W | 0.9391 |
98 | ATO | 0.9385 |
99 | 3GR | 0.9382 |
100 | L60 | 0.9382 |
101 | 2RA | 0.9380 |
102 | MLM | 0.9379 |
103 | 2A1 | 0.9377 |
104 | PZO | 0.9375 |
105 | 9PO | 0.9370 |
106 | 5MP | 0.9368 |
107 | 2IM | 0.9365 |
108 | 7EX | 0.9354 |
109 | 3ZQ | 0.9350 |
110 | BUB | 0.9348 |
111 | MEU | 0.9345 |
112 | ABA | 0.9342 |
113 | TRI | 0.9339 |
114 | MZY | 0.9332 |
115 | E60 | 0.9329 |
116 | MTG | 0.9325 |
117 | PXO | 0.9324 |
118 | JZ6 | 0.9323 |
119 | SMB | 0.9322 |
120 | 24T | 0.9318 |
121 | A2Q | 0.9317 |
122 | LGA | 0.9315 |
123 | 5KX | 0.9314 |
124 | HVK | 0.9313 |
125 | HUH | 0.9304 |
126 | J3K | 0.9302 |
127 | HRZ | 0.9301 |
128 | CAQ | 0.9301 |
129 | 93B | 0.9300 |
130 | IMD | 0.9298 |
131 | EGD | 0.9298 |
132 | 2AP | 0.9294 |
133 | 23W | 0.9293 |
134 | 3AP | 0.9290 |
135 | 40O | 0.9284 |
136 | MBN | 0.9278 |
137 | HV2 | 0.9271 |
138 | V1L | 0.9270 |
139 | WOT | 0.9269 |
140 | 3CL | 0.9267 |
141 | 4XX | 0.9266 |
142 | 4AP | 0.9265 |
143 | 76X | 0.9263 |
144 | L89 | 0.9262 |
145 | 93Q | 0.9256 |
146 | ES3 | 0.9256 |
147 | 39J | 0.9255 |
148 | XAP | 0.9254 |
149 | FP2 | 0.9243 |
150 | CP2 | 0.9241 |
151 | 1AN | 0.9241 |
152 | JZ0 | 0.9239 |
153 | DMG | 0.9237 |
154 | A3B | 0.9235 |
155 | 2AF | 0.9231 |
156 | CHT | 0.9229 |
157 | AAE | 0.9228 |
158 | 938 | 0.9226 |
159 | ETF | 0.9224 |
160 | XIX | 0.9221 |
161 | OXE | 0.9220 |
162 | J1Z | 0.9219 |
163 | CYH | 0.9217 |
164 | BXA | 0.9213 |
165 | 92Z | 0.9212 |
166 | GXE | 0.9203 |
167 | 8LG | 0.9199 |
168 | 1BP | 0.9196 |
169 | PYZ | 0.9189 |
170 | CXL | 0.9188 |
171 | BYZ | 0.9187 |
172 | MZ0 | 0.9178 |
173 | 192 | 0.9168 |
174 | SLP | 0.9162 |
175 | BEW | 0.9158 |
176 | 2CH | 0.9154 |
177 | HAI | 0.9148 |
178 | HTS | 0.9145 |
179 | 2HA | 0.9139 |
180 | DTL | 0.9131 |
181 | TCV | 0.9123 |
182 | HHN | 0.9120 |
183 | TTO | 0.9118 |
184 | DBB | 0.9112 |
185 | LER | 0.9104 |
186 | MRY | 0.9103 |
187 | PIH | 0.9103 |
188 | HGW | 0.9101 |
189 | 8CL | 0.9094 |
190 | PRS | 0.9092 |
191 | FMS | 0.9071 |
192 | YAN | 0.9069 |
193 | H3M | 0.9069 |
194 | PRI | 0.9064 |
195 | TFB | 0.9064 |
196 | 6X8 | 0.9060 |
197 | BAE | 0.9044 |
198 | CEJ | 0.9044 |
199 | P2D | 0.9039 |
200 | 280 | 0.9038 |
201 | PRO | 0.9035 |
202 | 25T | 0.9026 |
203 | TMZ | 0.9026 |
204 | CYT | 0.9024 |
205 | NVI | 0.9021 |
206 | LG3 | 0.9019 |
207 | FJO | 0.9018 |
208 | HSW | 0.9017 |
209 | RCO | 0.9016 |
210 | 8GF | 0.9008 |
211 | ETM | 0.9006 |
212 | DUC | 0.8997 |
213 | FOA | 0.8994 |
214 | 2PC | 0.8990 |
215 | TAU | 0.8986 |
216 | IVA | 0.8985 |
217 | HPY | 0.8985 |
218 | URA | 0.8978 |
219 | CRS | 0.8974 |
220 | MMU | 0.8970 |
221 | 26D | 0.8968 |
222 | LG5 | 0.8965 |
223 | 285 | 0.8964 |
224 | 8X3 | 0.8963 |
225 | VSO | 0.8941 |
226 | 3CH | 0.8940 |
227 | JBN | 0.8938 |
228 | BVF | 0.8938 |
229 | TMT | 0.8937 |
230 | 1DH | 0.8936 |
231 | PYC | 0.8932 |
232 | 278 | 0.8927 |
233 | CIG | 0.8914 |
234 | 2HE | 0.8914 |
235 | JAB | 0.8908 |
236 | TFS | 0.8905 |
237 | MAK | 0.8895 |
238 | DCD | 0.8895 |
239 | MSF | 0.8890 |
240 | KIV | 0.8888 |
241 | TAN | 0.8875 |
242 | ODV | 0.8874 |
243 | BVC | 0.8872 |
244 | POA | 0.8852 |
245 | PCR | 0.8851 |
246 | DPR | 0.8843 |
247 | PXY | 0.8838 |
248 | 265 | 0.8838 |
249 | ICN | 0.8836 |
250 | PAE | 0.8830 |
251 | HQE | 0.8826 |
252 | HEW | 0.8823 |
253 | DTU | 0.8822 |
254 | LG4 | 0.8822 |
255 | DAB | 0.8821 |
256 | BVG | 0.8821 |
257 | B3R | 0.8817 |
258 | 25R | 0.8810 |
259 | TP5 | 0.8809 |
260 | M3T | 0.8803 |
261 | RSF | 0.8800 |
262 | HVQ | 0.8800 |
263 | 2MH | 0.8798 |
264 | PLQ | 0.8793 |
265 | FCN | 0.8790 |
266 | 4CH | 0.8778 |
267 | NCM | 0.8777 |
268 | HGQ | 0.8775 |
269 | YHO | 0.8773 |
270 | FPN | 0.8768 |
271 | 2EZ | 0.8764 |
272 | DA1 | 0.8762 |
273 | 1MC | 0.8756 |
274 | HCS | 0.8753 |
275 | 284 | 0.8749 |
276 | RP7 | 0.8744 |
277 | SYN | 0.8742 |
278 | CNH | 0.8737 |
279 | TB0 | 0.8737 |
280 | 4JN | 0.8734 |
281 | 4H2 | 0.8731 |
282 | ICP | 0.8728 |
283 | ITU | 0.8726 |
284 | HHQ | 0.8725 |
285 | PUT | 0.8721 |
286 | MCT | 0.8714 |
287 | MWM | 0.8704 |
288 | CP | 0.8703 |
289 | 4HO | 0.8701 |
290 | 5MH | 0.8695 |
291 | BML | 0.8694 |
292 | 4JU | 0.8692 |
293 | 1DU | 0.8690 |
294 | ECE | 0.8686 |
295 | 1XX | 0.8676 |
296 | ICC | 0.8671 |
297 | JZ2 | 0.8671 |
298 | 4DX | 0.8663 |
299 | IDH | 0.8660 |
300 | 8FH | 0.8658 |
301 | URF | 0.8654 |
302 | MZG | 0.8652 |
303 | A1U | 0.8646 |
304 | MMQ | 0.8640 |
305 | WBU | 0.8637 |
306 | MWJ | 0.8635 |
307 | NEQ | 0.8635 |
308 | TDR | 0.8633 |
309 | 282 | 0.8633 |
310 | FPY | 0.8632 |
311 | 5UC | 0.8631 |
312 | 27Y | 0.8620 |
313 | SMV | 0.8610 |
314 | FLM | 0.8596 |
315 | MTD | 0.8572 |
316 | 3MC | 0.8568 |
317 | ACM | 0.8563 |
318 | ABN | 0.8553 |
319 | OSM | 0.8538 |
320 | HBX | 0.8508 |