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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 266 families. | |||||
1 | 2F7C | - | CCU | C6 H6 O4 | C(=C/C(=O).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 220 families. | |||||
1 | 2F78 | Kd = 1 mM | BEZ | C7 H6 O2 | c1ccc(cc1).... |
2 | 2F7A | Kd = 1 mM | BEZ | C7 H6 O2 | c1ccc(cc1).... |
3 | 2F7C | - | CCU | C6 H6 O4 | C(=C/C(=O).... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 11C | 0.9628 |
2 | GLN | 0.9580 |
3 | AKG | 0.9535 |
4 | 0L1 | 0.9483 |
5 | HPN | 0.9461 |
6 | 2FM | 0.9461 |
7 | GUA | 0.9402 |
8 | N6C | 0.9371 |
9 | DHI | 0.9368 |
10 | HIS | 0.9353 |
11 | HHI | 0.9346 |
12 | OOG | 0.9318 |
13 | ACA | 0.9311 |
14 | KQY | 0.9302 |
15 | S8V | 0.9291 |
16 | MHN | 0.9261 |
17 | URO | 0.9237 |
18 | CCE | 0.9235 |
19 | TIH | 0.9222 |
20 | S2G | 0.9219 |
21 | HSO | 0.9217 |
22 | PPY | 0.9216 |
23 | UN1 | 0.9203 |
24 | OGA | 0.9202 |
25 | GGL | 0.9200 |
26 | AG2 | 0.9199 |
27 | O45 | 0.9196 |
28 | GPJ | 0.9190 |
29 | 152 | 0.9176 |
30 | GLU | 0.9173 |
31 | ARG | 0.9173 |
32 | 4LR | 0.9160 |
33 | OEG | 0.9160 |
34 | HG3 | 0.9160 |
35 | DPN | 0.9158 |
36 | DE5 | 0.9150 |
37 | 3PG | 0.9150 |
38 | 7BC | 0.9148 |
39 | G3P | 0.9147 |
40 | DGN | 0.9140 |
41 | GPF | 0.9133 |
42 | BNF | 0.9128 |
43 | PO6 | 0.9125 |
44 | 3YP | 0.9122 |
45 | SME | 0.9120 |
46 | LYS | 0.9115 |
47 | ILO | 0.9108 |
48 | ORN | 0.9108 |
49 | M45 | 0.9106 |
50 | SNU | 0.9102 |
51 | DZA | 0.9096 |
52 | CCD | 0.9096 |
53 | MSR | 0.9087 |
54 | PIM | 0.9086 |
55 | TYL | 0.9084 |
56 | NFA | 0.9083 |
57 | OKG | 0.9082 |
58 | F98 | 0.9074 |
59 | PGH | 0.9071 |
60 | NM3 | 0.9069 |
61 | IXW | 0.9066 |
62 | 3LR | 0.9062 |
63 | M3H | 0.9054 |
64 | 1L5 | 0.9051 |
65 | ONH | 0.9049 |
66 | NF3 | 0.9045 |
67 | FOM | 0.9045 |
68 | NM2 | 0.9044 |
69 | PHE | 0.9039 |
70 | ENV | 0.9039 |
71 | ONL | 0.9038 |
72 | AT3 | 0.9035 |
73 | 4LW | 0.9028 |
74 | AMH | 0.9023 |
75 | HFA | 0.9021 |
76 | SIN | 0.9015 |
77 | AL0 | 0.9013 |
78 | 650 | 0.9011 |
79 | 6NI | 0.9008 |
80 | E4P | 0.9007 |
81 | XIZ | 0.9007 |
82 | KMH | 0.9006 |
83 | HGA | 0.9006 |
84 | 49F | 0.9005 |
85 | SNO | 0.9005 |
86 | 0VT | 0.9004 |
87 | 13P | 0.9003 |
88 | FK8 | 0.9003 |
89 | OAA | 0.8996 |
90 | 5XA | 0.8995 |
91 | GJZ | 0.8995 |
92 | 3HG | 0.8989 |
93 | AHN | 0.8988 |
94 | 2HG | 0.8984 |
95 | LYN | 0.8983 |
96 | HCI | 0.8982 |
97 | GVM | 0.8977 |
98 | TSU | 0.8968 |
99 | A5E | 0.8966 |
100 | TCA | 0.8965 |
101 | AOT | 0.8965 |
102 | J9N | 0.8963 |
103 | CHH | 0.8963 |
104 | HC4 | 0.8961 |
105 | MAH | 0.8960 |
106 | 2BX | 0.8956 |
107 | G3H | 0.8956 |
108 | DAR | 0.8953 |
109 | 129 | 0.8947 |
110 | 5WZ | 0.8946 |
111 | AMS | 0.8945 |
112 | YRL | 0.8945 |
113 | TEG | 0.8945 |
114 | MZT | 0.8944 |
115 | 173 | 0.8940 |
116 | CPZ | 0.8936 |
117 | F4E | 0.8936 |
118 | L14 | 0.8934 |
119 | 3S5 | 0.8929 |
120 | PIY | 0.8928 |
121 | R2P | 0.8927 |
122 | BNL | 0.8925 |
123 | 6FZ | 0.8924 |
124 | NLE | 0.8923 |
125 | NPO | 0.8920 |
126 | 4WL | 0.8918 |
127 | OTR | 0.8918 |
128 | HX4 | 0.8917 |
129 | PZM | 0.8917 |
130 | TYR | 0.8911 |
131 | 0BP | 0.8909 |
132 | VKC | 0.8909 |
133 | OCT | 0.8907 |
134 | RUJ | 0.8906 |
135 | GP9 | 0.8903 |
136 | 4J8 | 0.8897 |
137 | C1M | 0.8896 |
138 | 16D | 0.8894 |
139 | BPN | 0.8892 |
140 | PNZ | 0.8890 |
141 | ISZ | 0.8887 |
142 | GWM | 0.8886 |
143 | SEP | 0.8886 |
144 | 36Y | 0.8882 |
145 | HIC | 0.8880 |
146 | IP8 | 0.8879 |
147 | SSC | 0.8876 |
148 | FOC | 0.8874 |
149 | FBS | 0.8874 |
150 | 9ON | 0.8871 |
151 | S2P | 0.8871 |
152 | SAN | 0.8870 |
153 | 2IT | 0.8869 |
154 | A29 | 0.8868 |
155 | 4LV | 0.8867 |
156 | MET | 0.8866 |
157 | DGL | 0.8864 |
158 | 7VP | 0.8864 |
159 | HNL | 0.8864 |
160 | HNK | 0.8864 |
161 | 4PN | 0.8863 |
162 | CFI | 0.8861 |
163 | OCA | 0.8860 |
164 | PAC | 0.8859 |
165 | 5NI | 0.8857 |
166 | KTA | 0.8857 |
167 | PHB | 0.8854 |
168 | TZF | 0.8853 |
169 | SSB | 0.8852 |
170 | GLY GLY | 0.8850 |
171 | 64Z | 0.8847 |
172 | AEF | 0.8847 |
173 | HHH | 0.8844 |
174 | B85 | 0.8844 |
175 | LQ2 | 0.8842 |
176 | NIZ | 0.8840 |
177 | 6NA | 0.8840 |
178 | CXP | 0.8840 |
179 | N9J | 0.8839 |
180 | NYL | 0.8835 |
181 | E5X | 0.8834 |
182 | PC | 0.8834 |
183 | PH3 | 0.8831 |
184 | DAV | 0.8831 |
185 | HBD | 0.8828 |
186 | ENO | 0.8827 |
187 | SD4 | 0.8826 |
188 | ESP | 0.8826 |
189 | 268 | 0.8824 |
190 | 4BZ | 0.8822 |
191 | PG3 | 0.8821 |
192 | 4FA | 0.8819 |
193 | ANN | 0.8819 |
194 | BHO | 0.8818 |
195 | HDH | 0.8816 |
196 | SHO | 0.8814 |
197 | DHM | 0.8814 |
198 | ICB | 0.8813 |
199 | ESX | 0.8812 |
200 | PGA | 0.8812 |
201 | MLT | 0.8812 |
202 | 1PS | 0.8809 |
203 | DXP | 0.8809 |
204 | GO2 | 0.8805 |
205 | XRG | 0.8805 |
206 | PHU | 0.8802 |
207 | BZ2 | 0.8794 |
208 | YZM | 0.8793 |
209 | M4T | 0.8793 |
210 | 1Y6 | 0.8791 |
211 | 4ZA | 0.8786 |
212 | LMR | 0.8785 |
213 | RNO | 0.8784 |
214 | 1GP | 0.8782 |
215 | 4P5 | 0.8782 |
216 | YPN | 0.8782 |
217 | 4JC | 0.8782 |
218 | K34 | 0.8781 |
219 | TPA | 0.8780 |
220 | MEQ | 0.8777 |
221 | CXF | 0.8775 |
222 | B40 | 0.8773 |
223 | 36E | 0.8772 |
224 | P81 | 0.8772 |
225 | FBM | 0.8770 |
226 | PRA | 0.8769 |
227 | 1X4 | 0.8767 |
228 | F4K | 0.8763 |
229 | J6W | 0.8760 |
230 | 4NM | 0.8760 |
231 | QMP | 0.8758 |
232 | LTL | 0.8754 |
233 | E79 | 0.8754 |
234 | RAT | 0.8752 |
235 | OK7 | 0.8752 |
236 | 1F1 | 0.8751 |
237 | RP3 | 0.8749 |
238 | NSB | 0.8743 |
239 | NPI | 0.8743 |
240 | NCT | 0.8741 |
241 | PBA | 0.8737 |
242 | 4NB | 0.8735 |
243 | 9GB | 0.8735 |
244 | 3AE | 0.8734 |
245 | HL5 | 0.8730 |
246 | DHC | 0.8729 |
247 | YIE | 0.8728 |
248 | SHI | 0.8728 |
249 | EVF | 0.8725 |
250 | M4S | 0.8724 |
251 | 0HN | 0.8723 |
252 | 717 | 0.8723 |
253 | S7J | 0.8721 |
254 | EOU | 0.8721 |
255 | DHR | 0.8720 |
256 | LR5 | 0.8719 |
257 | RTK | 0.8719 |
258 | 428 | 0.8717 |
259 | HL4 | 0.8716 |
260 | FCR | 0.8715 |
261 | AAS | 0.8712 |
262 | FBF | 0.8710 |
263 | IWT | 0.8707 |
264 | GVY | 0.8707 |
265 | GOJ | 0.8706 |
266 | KDG | 0.8705 |
267 | MHO | 0.8705 |
268 | MSL | 0.8702 |
269 | FAN | 0.8702 |
270 | 258 | 0.8700 |
271 | ALE | 0.8695 |
272 | 2BG | 0.8691 |
273 | JAW | 0.8687 |
274 | SN4 | 0.8686 |
275 | I3E | 0.8686 |
276 | LNR | 0.8684 |
277 | 5LA | 0.8684 |
278 | K7M | 0.8683 |
279 | GVG | 0.8679 |
280 | JDN | 0.8678 |
281 | LDP | 0.8676 |
282 | MPV | 0.8672 |
283 | 7O4 | 0.8671 |
284 | PBZ | 0.8670 |
285 | 5XB | 0.8663 |
286 | 1BN | 0.8660 |
287 | 8NB | 0.8654 |
288 | CIR | 0.8648 |
289 | R20 | 0.8647 |
290 | 2ZM | 0.8643 |
291 | 6NT | 0.8640 |
292 | 4MA | 0.8633 |
293 | 12T | 0.8632 |
294 | 1M2 | 0.8631 |
295 | P7Y | 0.8630 |
296 | JB8 | 0.8626 |
297 | C82 | 0.8625 |
298 | PPT | 0.8624 |
299 | 2QC | 0.8622 |
300 | KBZ | 0.8616 |
301 | PJW | 0.8616 |
302 | HQJ | 0.8616 |
303 | MEV | 0.8611 |
304 | 2HC | 0.8610 |
305 | XIY | 0.8608 |
306 | 0HO | 0.8605 |
307 | I1E | 0.8601 |
308 | 3A9 | 0.8600 |
309 | MAJ | 0.8594 |
310 | FHC | 0.8593 |
311 | HPS | 0.8593 |
312 | 80G | 0.8590 |
313 | ALA ALA | 0.8590 |
314 | TZM | 0.8584 |
315 | HPP | 0.8580 |
316 | 4NZ | 0.8577 |
317 | N4E | 0.8576 |
318 | 069 | 0.8575 |
319 | MSE | 0.8571 |
320 | L5V | 0.8565 |
321 | LLH | 0.8565 |
322 | RUY | 0.8557 |
323 | 3ZB | 0.8554 |
324 | SOR | 0.8539 |
325 | 1KA | 0.8538 |
326 | ABI | 0.8531 |
327 | 1SH | 0.8531 |
328 | KTJ | 0.8529 |
329 | HNH | 0.8529 |
This union binding pocket(no: 1) in the query (biounit: 2f7c.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 2f7c.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |