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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 | 1SS4 | - | CIT | C6 H8 O7 | C(C(=O)O)C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 223 families. | |||||
1 | 1SS4 | - | CIT | C6 H8 O7 | C(C(=O)O)C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | GSH | 1 | 1 |
2 | HCG | 0.75 | 0.973684 |
3 | HGS | 0.730769 | 0.925 |
4 | GSM | 0.690909 | 0.878049 |
5 | GDS | 0.672727 | 0.837209 |
6 | GS8 | 0.672727 | 0.840909 |
7 | GTS | 0.672727 | 0.660714 |
8 | GSF | 0.660714 | 0.72549 |
9 | AHE | 0.649123 | 0.9 |
10 | 3GC | 0.645833 | 0.918919 |
11 | HGD | 0.637931 | 0.837209 |
12 | GCG | 0.6 | 0.860465 |
13 | KGT | 0.592593 | 0.923077 |
14 | TGG | 0.587302 | 0.9 |
15 | BWS | 0.581818 | 0.871795 |
16 | TS5 | 0.573529 | 0.880952 |
17 | 0HH | 0.528571 | 0.782609 |
18 | GSB | 0.528571 | 0.878049 |
19 | KSN | 0.528302 | 0.789474 |
20 | GSO | 0.521127 | 0.857143 |
21 | BOB | 0.493506 | 0.75 |
22 | GTB | 0.493333 | 0.631579 |
23 | P9H | 0.486842 | 0.857143 |
24 | GBI | 0.486842 | 0.782609 |
25 | 48T | 0.481013 | 0.8 |
26 | L9X | 0.480519 | 0.62069 |
27 | GTD | 0.480519 | 0.6 |
28 | ESG | 0.480519 | 0.62069 |
29 | 1R4 | 0.474359 | 0.62069 |
30 | GIP | 0.474359 | 0.6 |
31 | GPS | 0.468354 | 0.72 |
32 | GPR | 0.468354 | 0.72 |
33 | GBP | 0.468354 | 0.6 |
34 | GAZ | 0.457831 | 0.679245 |
35 | GVX | 0.45679 | 0.8 |
36 | HFV | 0.447761 | 0.8 |
37 | ASV | 0.446154 | 0.9 |
38 | GNB | 0.445783 | 0.6 |
39 | W05 | 0.444444 | 0.923077 |
40 | VB1 | 0.444444 | 0.9 |
41 | LZ6 | 0.436782 | 0.692308 |
42 | ACV | 0.430769 | 0.878049 |
43 | BCV | 0.424242 | 0.9 |
44 | CDH | 0.424242 | 0.818182 |
45 | 2G2 | 0.42029 | 0.615385 |
46 | HGA | 0.42 | 0.622222 |
47 | M8F | 0.411765 | 0.837209 |
48 | MEQ | 0.411765 | 0.658537 |
49 | TS4 | 0.410256 | 0.804348 |
50 | M9F | 0.405797 | 0.837209 |
51 | KKA | 0.4 | 0.894737 |
52 | M2W | 0.4 | 0.8 |
53 | ACW | 0.4 | 0.8 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | FLC | 1.0000 |
2 | PEP | 1.0000 |
3 | NTC | 0.9827 |
4 | 7A2 | 0.9729 |
5 | 7A3 | 0.9710 |
6 | TRC | 0.9632 |
7 | ICT | 0.9604 |
8 | NCD | 0.9568 |
9 | 1AL | 0.9557 |
10 | TRA | 0.9465 |
11 | GLY LEU | 0.9431 |
12 | ENL | 0.9421 |
13 | P4B | 0.9413 |
14 | EKN | 0.9407 |
15 | AN0 | 0.9405 |
16 | 4TE | 0.9372 |
17 | NFQ | 0.9367 |
18 | GLY ASP | 0.9365 |
19 | ATH | 0.9359 |
20 | 3S4 | 0.9303 |
21 | 0FA | 0.9302 |
22 | HCT | 0.9298 |
23 | GBN | 0.9289 |
24 | NLQ | 0.9287 |
25 | NQM | 0.9280 |
26 | XQB | 0.9278 |
27 | CAX | 0.9276 |
28 | NLG | 0.9268 |
29 | JKZ | 0.9254 |
30 | AKH | 0.9252 |
31 | MIC | 0.9251 |
32 | AOR | 0.9244 |
33 | 5UK | 0.9243 |
34 | AVI | 0.9237 |
35 | 5XB | 0.9229 |
36 | IPM | 0.9222 |
37 | 5XR | 0.9215 |
38 | CCB | 0.9212 |
39 | PHT | 0.9208 |
40 | GJS | 0.9195 |
41 | IJZ | 0.9193 |
42 | Q6T | 0.9189 |
43 | AVJ | 0.9180 |
44 | VPR | 0.9176 |
45 | C5A | 0.9170 |
46 | OTD | 0.9170 |
47 | GM7 | 0.9167 |
48 | 87L | 0.9166 |
49 | 2CG | 0.9164 |
50 | KAI | 0.9162 |
51 | 449 | 0.9160 |
52 | DII | 0.9156 |
53 | FOT | 0.9156 |
54 | 256 | 0.9150 |
55 | FBG | 0.9150 |
56 | J01 | 0.9145 |
57 | HMQ | 0.9139 |
58 | NIG | 0.9130 |
59 | TEN | 0.9130 |
60 | NTM | 0.9127 |
61 | R9S | 0.9118 |
62 | H6B | 0.9116 |
63 | CDV | 0.9112 |
64 | PRZ | 0.9112 |
65 | 8WQ | 0.9110 |
66 | 2AL | 0.9109 |
67 | 40F | 0.9109 |
68 | 42C | 0.9107 |
69 | 791 | 0.9106 |
70 | HLD | 0.9105 |
71 | 0GZ | 0.9105 |
72 | HJP | 0.9105 |
73 | AME | 0.9104 |
74 | 0F9 | 0.9103 |
75 | OIA | 0.9103 |
76 | V6F | 0.9103 |
77 | ONR | 0.9101 |
78 | ALA LEU | 0.9100 |
79 | OMD | 0.9100 |
80 | HQ9 | 0.9100 |
81 | DMO | 0.9096 |
82 | CDT | 0.9095 |
83 | KTA | 0.9095 |
84 | BRR | 0.9092 |
85 | GLY PRO | 0.9092 |
86 | 6CS | 0.9084 |
87 | 5WY | 0.9084 |
88 | R1P | 0.9081 |
89 | MEV | 0.9081 |
90 | DG2 | 0.9079 |
91 | KDF | 0.9079 |
92 | PDC | 0.9079 |
93 | M44 | 0.9078 |
94 | GZ8 | 0.9077 |
95 | 41K | 0.9076 |
96 | ORO | 0.9068 |
97 | AIN | 0.9067 |
98 | FX1 | 0.9066 |
99 | 8G0 | 0.9065 |
100 | SIF | 0.9064 |
101 | T2D | 0.9062 |
102 | 6LW | 0.9060 |
103 | AVO | 0.9059 |
104 | 5HY | 0.9059 |
105 | HJ7 | 0.9058 |
106 | FF3 | 0.9058 |
107 | QAS | 0.9057 |
108 | IPZ | 0.9056 |
109 | PD2 | 0.9055 |
110 | PCV | 0.9054 |
111 | DOR | 0.9054 |
112 | 34D | 0.9052 |
113 | 4ME | 0.9049 |
114 | YQA | 0.9047 |
115 | L14 | 0.9045 |
116 | G88 | 0.9045 |
117 | 9SE | 0.9045 |
118 | FRU | 0.9044 |
119 | GTQ | 0.9042 |
120 | C2U | 0.9041 |
121 | OAF | 0.9040 |
122 | 6XI | 0.9040 |
123 | DNC | 0.9040 |
124 | DNF | 0.9040 |
125 | 6NI | 0.9034 |
126 | 4WK | 0.9033 |
127 | D1X | 0.9032 |
128 | 0OC | 0.9028 |
129 | SF6 | 0.9027 |
130 | ZZ8 | 0.9027 |
131 | QAT | 0.9026 |
132 | QIC | 0.9023 |
133 | 091 | 0.9023 |
134 | 8VN | 0.9020 |
135 | FA6 | 0.9020 |
136 | 5CU | 0.9017 |
137 | 2ZM | 0.9017 |
138 | 97T | 0.9016 |
139 | 9PY | 0.9016 |
140 | 1U1 | 0.9014 |
141 | 6NT | 0.9014 |
142 | J9Q | 0.9013 |
143 | TSA | 0.9012 |
144 | AH8 | 0.9008 |
145 | ET2 | 0.9008 |
146 | ANN | 0.9008 |
147 | 5OB | 0.9006 |
148 | KJM | 0.9005 |
149 | GCU | 0.9005 |
150 | 0HO | 0.9004 |
151 | 1F1 | 0.9004 |
152 | 6R8 | 0.9002 |
153 | 2PG | 0.9001 |
154 | S2T | 0.9000 |
155 | KLW | 0.8998 |
156 | 2FT | 0.8997 |
157 | BZ3 | 0.8997 |
158 | N8P | 0.8996 |
159 | SHA | 0.8995 |
160 | GV9 | 0.8994 |
161 | 40H | 0.8992 |
162 | N7P | 0.8991 |
163 | GAF | 0.8990 |
164 | FUD | 0.8989 |
165 | 5NU | 0.8988 |
166 | 3NY | 0.8988 |
167 | G01 | 0.8987 |
168 | LSA | 0.8987 |
169 | K2P | 0.8986 |
170 | FA3 | 0.8986 |
171 | 54G | 0.8986 |
172 | 2HU | 0.8984 |
173 | 2ZQ | 0.8984 |
174 | 3AL | 0.8984 |
175 | FA1 | 0.8984 |
176 | 5NI | 0.8983 |
177 | KJU | 0.8980 |
178 | XX3 | 0.8979 |
179 | DOB | 0.8978 |
180 | QPR | 0.8978 |
181 | GLY MET | 0.8978 |
182 | PRE | 0.8977 |
183 | 4M0 | 0.8976 |
184 | RAT | 0.8975 |
185 | 0HN | 0.8975 |
186 | Z5P | 0.8971 |
187 | 0GY | 0.8971 |
188 | FA0 | 0.8971 |
189 | PNZ | 0.8971 |
190 | 3A9 | 0.8970 |
191 | F12 | 0.8970 |
192 | OW7 | 0.8969 |
193 | 5FN | 0.8968 |
194 | ICO | 0.8968 |
195 | KDG | 0.8966 |
196 | DIG | 0.8965 |
197 | E5X | 0.8965 |
198 | JAW | 0.8964 |
199 | RD4 | 0.8964 |
200 | GNL | 0.8963 |
201 | NSG | 0.8963 |
202 | OXC | 0.8963 |
203 | 3MF | 0.8962 |
204 | 60Q | 0.8962 |
205 | AQK | 0.8960 |
206 | BHA | 0.8960 |
207 | SSC | 0.8959 |
208 | ADA | 0.8959 |
209 | OEM | 0.8958 |
210 | XSP | 0.8957 |
211 | 3MB | 0.8957 |
212 | 7WR | 0.8956 |
213 | ES2 | 0.8955 |
214 | NVU | 0.8954 |
215 | KBB | 0.8954 |
216 | QM1 | 0.8953 |
217 | APG | 0.8953 |
218 | 2LY | 0.8952 |
219 | 5RG | 0.8950 |
220 | BGT | 0.8950 |
221 | XYH | 0.8949 |
222 | 1PL | 0.8947 |
223 | 8GK | 0.8947 |
224 | OVM | 0.8946 |
225 | B2Y | 0.8946 |
226 | ABI | 0.8944 |
227 | CLW | 0.8944 |
228 | URC | 0.8944 |
229 | 5ZZ | 0.8942 |
230 | SF9 | 0.8941 |
231 | 2MN | 0.8937 |
232 | 7UC | 0.8936 |
233 | 9TZ | 0.8936 |
234 | AMH | 0.8935 |
235 | 210 | 0.8935 |
236 | TSR | 0.8935 |
237 | 4P5 | 0.8934 |
238 | ODO | 0.8934 |
239 | GCV | 0.8933 |
240 | VGD | 0.8932 |
241 | 15N | 0.8931 |
242 | SOE | 0.8928 |
243 | 2BX | 0.8927 |
244 | 3S6 | 0.8926 |
245 | GIO | 0.8926 |
246 | 15L | 0.8925 |
247 | NDG | 0.8923 |
248 | VNL | 0.8923 |
249 | IPB | 0.8923 |
250 | PSV | 0.8921 |
251 | SDD | 0.8919 |
252 | 1CO | 0.8919 |
253 | G5V | 0.8919 |
254 | 8WO | 0.8919 |
255 | GTR | 0.8918 |
256 | OW4 | 0.8918 |
257 | LFC | 0.8917 |
258 | N2I | 0.8917 |
259 | QBK | 0.8917 |
260 | N2Z | 0.8916 |
261 | 52C | 0.8916 |
262 | 5M0 | 0.8916 |
263 | 45L | 0.8916 |
264 | CWJ | 0.8915 |
265 | 7ZE | 0.8915 |
266 | JB8 | 0.8914 |
267 | SKM | 0.8913 |
268 | I3A | 0.8913 |
269 | NCT | 0.8912 |
270 | DQA | 0.8910 |
271 | SR4 | 0.8909 |
272 | SC2 | 0.8908 |
273 | HA7 | 0.8908 |
274 | 5XC | 0.8907 |
275 | LFR | 0.8907 |
276 | MMA | 0.8907 |
277 | HNQ | 0.8907 |
278 | 069 | 0.8905 |
279 | X1E | 0.8904 |
280 | 7NI | 0.8904 |
281 | 9FL | 0.8904 |
282 | RNS | 0.8904 |
283 | TIU | 0.8904 |
284 | 5MK | 0.8903 |
285 | II6 | 0.8902 |
286 | X09 | 0.8900 |
287 | NGO | 0.8899 |
288 | 5GU | 0.8897 |
289 | M75 | 0.8897 |
290 | H62 | 0.8896 |
291 | 2M5 | 0.8896 |
292 | 9KH | 0.8896 |
293 | REL | 0.8895 |
294 | JDN | 0.8894 |
295 | GZQ | 0.8894 |
296 | LAO | 0.8893 |
297 | E7Z | 0.8892 |
298 | 4CS | 0.8892 |
299 | GTC | 0.8891 |
300 | 5RN | 0.8891 |
301 | AI2 | 0.8890 |
302 | 6JN | 0.8889 |
303 | GTL | 0.8889 |
304 | IAC | 0.8889 |
305 | LT8 | 0.8888 |
306 | 9CA | 0.8888 |
307 | AMG | 0.8888 |
308 | SOL | 0.8887 |
309 | A13 | 0.8887 |
310 | IFL | 0.8887 |
311 | BDF | 0.8885 |
312 | 1P8 | 0.8885 |
313 | DHK | 0.8885 |
314 | HDH | 0.8885 |
315 | PFL | 0.8884 |
316 | ALA PRO | 0.8882 |
317 | AS3 | 0.8881 |
318 | 36R | 0.8879 |
319 | AOS | 0.8879 |
320 | B0D | 0.8879 |
321 | KMH | 0.8878 |
322 | QUS | 0.8876 |
323 | AFR | 0.8875 |
324 | H42 | 0.8875 |
325 | PPK | 0.8875 |
326 | VXX | 0.8875 |
327 | PEZ | 0.8874 |
328 | M5N | 0.8872 |
329 | OHP | 0.8870 |
330 | MS9 | 0.8869 |
331 | GIV | 0.8869 |
332 | 03V | 0.8868 |
333 | A29 | 0.8868 |
334 | JJQ | 0.8867 |
335 | MNM | 0.8867 |
336 | 4FS | 0.8866 |
337 | NGT | 0.8866 |
338 | F31 | 0.8866 |
339 | KDO | 0.8866 |
340 | DEW | 0.8865 |
341 | 0JD | 0.8864 |
342 | 4VY | 0.8863 |
343 | 94W | 0.8862 |
344 | 92K | 0.8862 |
345 | DBX | 0.8862 |
346 | 8XQ | 0.8860 |
347 | 1IT | 0.8859 |
348 | EV0 | 0.8859 |
349 | 3PO | 0.8858 |
350 | F9Y | 0.8857 |
351 | M74 | 0.8857 |
352 | TAG | 0.8855 |
353 | 4WL | 0.8855 |
354 | DCO | 0.8855 |
355 | GCO | 0.8855 |
356 | 7VS | 0.8855 |
357 | M1E | 0.8855 |
358 | GC2 | 0.8854 |
359 | COU | 0.8854 |
360 | NGW | 0.8854 |
361 | 92P | 0.8854 |
362 | JA8 | 0.8854 |
363 | C2Y | 0.8853 |
364 | 6TZ | 0.8853 |
365 | BDP | 0.8853 |
366 | HA5 | 0.8852 |
367 | G4D | 0.8852 |
368 | B09 | 0.8852 |
369 | J9T | 0.8851 |
370 | GLA | 0.8851 |
371 | ES5 | 0.8850 |
372 | 5JQ | 0.8850 |
373 | GIF | 0.8850 |
374 | RNT | 0.8849 |
375 | CS2 | 0.8849 |
376 | 5DI | 0.8848 |
377 | SYV | 0.8848 |
378 | 8VE | 0.8848 |
379 | 8GL | 0.8847 |
380 | KDV | 0.8847 |
381 | 293 | 0.8847 |
382 | BZ2 | 0.8847 |
383 | KFH | 0.8847 |
384 | 8TX | 0.8846 |
385 | HDL | 0.8845 |
386 | L5V | 0.8845 |
387 | SXS | 0.8845 |
388 | IOS | 0.8845 |
389 | 8ZE | 0.8845 |
390 | 0CG | 0.8844 |
391 | JR2 | 0.8844 |
392 | MQB | 0.8843 |
393 | 787 | 0.8843 |
394 | 2FY | 0.8842 |
395 | 1U5 | 0.8842 |
396 | FBB | 0.8841 |
397 | HIS | 0.8840 |
398 | NAG | 0.8839 |
399 | NZ3 | 0.8839 |
400 | JB5 | 0.8839 |
401 | ASC | 0.8838 |
402 | 2HG | 0.8838 |
403 | 2AQ | 0.8837 |
404 | 2C0 | 0.8837 |
405 | CBF | 0.8837 |
406 | BK9 | 0.8836 |
407 | FIX | 0.8834 |
408 | 3IT | 0.8834 |
409 | GLO | 0.8833 |
410 | 3R9 | 0.8833 |
411 | M0W | 0.8833 |
412 | 1N4 | 0.8832 |
413 | TSS | 0.8830 |
414 | M4E | 0.8830 |
415 | PSJ | 0.8829 |
416 | GAL | 0.8829 |
417 | 3CR | 0.8828 |
418 | 4ZA | 0.8828 |
419 | 27L | 0.8828 |
420 | M0Q | 0.8828 |
421 | YIO | 0.8828 |
422 | MR1 | 0.8827 |
423 | 6FZ | 0.8827 |
424 | 1X7 | 0.8827 |
425 | FOC | 0.8826 |
426 | MUC | 0.8826 |
427 | 3BU | 0.8825 |
428 | BCU | 0.8825 |
429 | DZA | 0.8825 |
430 | AUD | 0.8825 |
431 | GOG | 0.8825 |
432 | 2TQ | 0.8825 |
433 | 61O | 0.8823 |
434 | LMR | 0.8823 |
435 | 2ED | 0.8822 |
436 | DIU | 0.8822 |
437 | 51R | 0.8822 |
438 | DBH | 0.8821 |
439 | 8S0 | 0.8821 |
440 | 4HC | 0.8821 |
441 | M72 | 0.8820 |
442 | 2C2 | 0.8820 |
443 | MLE | 0.8819 |
444 | 5VM | 0.8819 |
445 | SX1 | 0.8819 |
446 | MTL | 0.8818 |
447 | OCH | 0.8818 |
448 | 43W | 0.8818 |
449 | KYA | 0.8818 |
450 | FHN | 0.8817 |
451 | EUG | 0.8817 |
452 | 4Z4 | 0.8817 |
453 | F0J | 0.8817 |
454 | O2A | 0.8816 |
455 | 3HA | 0.8816 |
456 | TVP | 0.8816 |
457 | TLA | 0.8816 |
458 | 39U | 0.8816 |
459 | 3F0 | 0.8815 |
460 | M2K | 0.8814 |
461 | 56D | 0.8814 |
462 | GYE | 0.8813 |
463 | SOR | 0.8813 |
464 | 152 | 0.8813 |
465 | 3HG | 0.8812 |
466 | S76 | 0.8812 |
467 | FE DB1 | 0.8811 |
468 | XXP | 0.8810 |
469 | 4P0 | 0.8810 |
470 | BMA | 0.8810 |
471 | EYK | 0.8809 |
472 | GCB | 0.8809 |
473 | XAZ | 0.8808 |
474 | GDE | 0.8807 |
475 | 4A5 | 0.8806 |
476 | HBU | 0.8805 |
477 | 2GS | 0.8805 |
478 | GLR | 0.8804 |
479 | M5E | 0.8804 |
480 | FBV | 0.8804 |
481 | BTY | 0.8803 |
482 | GUN | 0.8803 |
483 | TPO | 0.8803 |
484 | DHS | 0.8802 |
485 | 1SV | 0.8802 |
486 | CSN | 0.8802 |
487 | FUC | 0.8802 |
488 | ESP | 0.8802 |
489 | 4BZ | 0.8802 |
490 | 2F6 | 0.8801 |
491 | CKX | 0.8801 |
492 | GLG | 0.8800 |
493 | 3MA | 0.8800 |
494 | XAN | 0.8800 |
495 | 3OC | 0.8800 |
496 | 463 | 0.8799 |
497 | AGK | 0.8799 |
498 | GLF | 0.8799 |
499 | K2T | 0.8798 |
500 | 4HM | 0.8798 |
501 | LPK | 0.8797 |
502 | 0RN | 0.8797 |
503 | 4NG | 0.8797 |
504 | R20 | 0.8796 |
505 | 3MG | 0.8796 |
506 | SN4 | 0.8795 |
507 | BCK | 0.8795 |
508 | 4NB | 0.8795 |
509 | EVA | 0.8795 |
510 | EA1 | 0.8793 |
511 | 9RH | 0.8792 |
512 | MVL | 0.8792 |
513 | V55 | 0.8792 |
514 | MBG | 0.8792 |
515 | AHD | 0.8791 |
516 | IUP | 0.8791 |
517 | 9DG | 0.8791 |
518 | 4NM | 0.8790 |
519 | 0LH | 0.8790 |
520 | G1P | 0.8790 |
521 | 7Y3 | 0.8790 |
522 | J9W | 0.8789 |
523 | ISD | 0.8788 |
524 | R8S | 0.8788 |
525 | 7D2 | 0.8788 |
526 | NHC | 0.8788 |
527 | 2O6 | 0.8788 |
528 | 3R6 | 0.8787 |
529 | 7N0 | 0.8785 |
530 | 6DP | 0.8785 |
531 | 263 | 0.8785 |
532 | 2A7 | 0.8785 |
533 | UEG | 0.8785 |
534 | OVV | 0.8785 |
535 | 42A | 0.8784 |
536 | YSO | 0.8784 |
537 | ZXD | 0.8783 |
538 | SVD | 0.8783 |
539 | 717 | 0.8783 |
540 | 12T | 0.8783 |
541 | X1R | 0.8782 |
542 | MNP | 0.8782 |
543 | 5RP | 0.8782 |
544 | AKG | 0.8782 |
545 | SYG | 0.8782 |
546 | 23J | 0.8780 |
547 | 8EW | 0.8779 |
548 | NZ2 | 0.8779 |
549 | RNO | 0.8779 |
550 | HXX | 0.8777 |
551 | 4JT | 0.8776 |
552 | RSM | 0.8776 |
553 | 329 | 0.8776 |
554 | BZX | 0.8775 |
555 | RB0 | 0.8774 |
556 | 1FF | 0.8774 |
557 | GLC | 0.8774 |
558 | ROR | 0.8774 |
559 | 75K | 0.8773 |
560 | Q71 | 0.8773 |
561 | SJ5 | 0.8773 |
562 | 149 | 0.8772 |
563 | 3HP | 0.8772 |
564 | BPN | 0.8772 |
565 | AQQ | 0.8771 |
566 | FYU | 0.8771 |
567 | IT9 | 0.8770 |
568 | BGC | 0.8770 |
569 | 4PN | 0.8769 |
570 | HHT | 0.8768 |
571 | UNC | 0.8768 |
572 | DZX | 0.8767 |
573 | 2LP | 0.8767 |
574 | 6KT | 0.8765 |
575 | NDH | 0.8765 |
576 | XIY | 0.8765 |
577 | 7MU | 0.8765 |
578 | MAJ | 0.8764 |
579 | P22 | 0.8764 |
580 | LQ2 | 0.8764 |
581 | B55 | 0.8763 |
582 | KIB | 0.8762 |
583 | LNR | 0.8761 |
584 | PHY | 0.8761 |
585 | DGJ | 0.8760 |
586 | 212 | 0.8760 |
587 | HQJ | 0.8759 |
588 | FPK | 0.8759 |
589 | FH2 | 0.8759 |
590 | ESX | 0.8759 |
591 | UAN | 0.8759 |
592 | 8H8 | 0.8758 |
593 | EJZ | 0.8757 |
594 | FCR | 0.8757 |
595 | GZL | 0.8756 |
596 | ICB | 0.8756 |
597 | 4AA | 0.8756 |
598 | K2Q | 0.8756 |
599 | 2FG | 0.8755 |
600 | GAB | 0.8755 |
601 | SRT | 0.8755 |
602 | CTL | 0.8754 |
603 | GVM | 0.8754 |
604 | Q7A | 0.8754 |
605 | LDP | 0.8753 |
606 | G3F | 0.8753 |
607 | VOH | 0.8753 |
608 | XUL | 0.8752 |
609 | F4E | 0.8752 |
610 | 7HQ | 0.8752 |
611 | LZM | 0.8751 |
612 | M3S | 0.8751 |
613 | 0UT | 0.8751 |
614 | IFG | 0.8750 |
615 | BFM | 0.8749 |
616 | 4JQ | 0.8748 |
617 | 2K4 | 0.8747 |
618 | AW5 | 0.8747 |
619 | X1P | 0.8747 |
620 | 3HB | 0.8747 |
621 | 2H5 | 0.8746 |
622 | 3C7 | 0.8746 |
623 | M3Q | 0.8746 |
624 | ISZ | 0.8746 |
625 | DA4 | 0.8745 |
626 | RES | 0.8745 |
627 | ASO | 0.8744 |
628 | 6VD | 0.8744 |
629 | DHB | 0.8743 |
630 | ZON | 0.8743 |
631 | SNO | 0.8743 |
632 | GXL | 0.8742 |
633 | PQK | 0.8742 |
634 | 428 | 0.8742 |
635 | SLC | 0.8742 |
636 | FXH | 0.8742 |
637 | 5RO | 0.8742 |
638 | 3V4 | 0.8741 |
639 | 1Z8 | 0.8741 |
640 | PHB | 0.8740 |
641 | ZOL | 0.8739 |
642 | NOY | 0.8739 |
643 | TAR | 0.8739 |
644 | ASF | 0.8739 |
645 | 9MG | 0.8739 |
646 | 20J | 0.8738 |
647 | AZ8 | 0.8736 |
648 | DAL DAL | 0.8736 |
649 | OVP | 0.8736 |
650 | G8M | 0.8736 |
651 | 259 | 0.8735 |
652 | 5MI | 0.8735 |
653 | 6RQ | 0.8734 |
654 | QDK | 0.8734 |
655 | X8Z | 0.8734 |
656 | BZS | 0.8734 |
657 | RIB | 0.8734 |
658 | FP1 | 0.8733 |
659 | 2AS | 0.8733 |
660 | MFU | 0.8732 |
661 | NID | 0.8730 |
662 | SER PRO | 0.8729 |
663 | 3PG | 0.8729 |
664 | SRO | 0.8729 |
665 | 5H1 | 0.8728 |
666 | 1P3 | 0.8728 |
667 | LGC | 0.8728 |
668 | XEN | 0.8728 |
669 | 8EZ | 0.8728 |
670 | 67Y | 0.8727 |
671 | EMZ | 0.8727 |
672 | 4I8 | 0.8726 |
673 | 1M2 | 0.8726 |
674 | INE | 0.8726 |
675 | 3NT | 0.8726 |
676 | 4RW | 0.8725 |
677 | 14O | 0.8725 |
678 | GTZ | 0.8725 |
679 | HLZ | 0.8724 |
680 | DIE | 0.8724 |
681 | OA3 | 0.8724 |
682 | 289 | 0.8723 |
683 | PAB | 0.8723 |
684 | ARW | 0.8722 |
685 | FBU | 0.8722 |
686 | PZI | 0.8721 |
687 | 4TU | 0.8721 |
688 | PEY | 0.8720 |
689 | 512 | 0.8720 |
690 | JV4 | 0.8720 |
691 | A2G | 0.8720 |
692 | MAN | 0.8720 |
693 | 3AB | 0.8720 |
694 | GLU | 0.8720 |
695 | AC6 | 0.8719 |
696 | XH2 | 0.8719 |
697 | 5QY | 0.8719 |
698 | 9FE | 0.8718 |
699 | PA1 | 0.8718 |
700 | DBJ | 0.8718 |
701 | DHI | 0.8718 |
702 | J6W | 0.8718 |
703 | 6AI | 0.8717 |
704 | DHY | 0.8717 |
705 | K97 | 0.8717 |
706 | BPS | 0.8716 |
707 | 46P | 0.8714 |
708 | GLY CYS | 0.8713 |
709 | 4FA | 0.8713 |
710 | 1WC | 0.8712 |
711 | 7Q1 | 0.8712 |
712 | 2BG | 0.8712 |
713 | 8XL | 0.8711 |
714 | XXG | 0.8711 |
715 | 4AV | 0.8711 |
716 | APZ | 0.8711 |
717 | SLS | 0.8710 |
718 | 2DR | 0.8710 |
719 | HYA | 0.8710 |
720 | C4L | 0.8709 |
721 | INO | 0.8709 |
722 | F34 | 0.8708 |
723 | QY9 | 0.8707 |
724 | A9O | 0.8707 |
725 | NOJ | 0.8707 |
726 | 1GN | 0.8706 |
727 | DMJ | 0.8705 |
728 | 9ZE | 0.8705 |
729 | 2CZ | 0.8705 |
730 | NGA | 0.8705 |
731 | AHB | 0.8704 |
732 | DPF | 0.8704 |
733 | M1Q | 0.8703 |
734 | MJ2 | 0.8703 |
735 | X6X | 0.8702 |
736 | MHK | 0.8702 |
737 | IV2 | 0.8701 |
738 | HMU | 0.8700 |
739 | 5LA | 0.8699 |
740 | SR1 | 0.8699 |
741 | I1E | 0.8699 |
742 | GOX | 0.8697 |
743 | QMS | 0.8697 |
744 | OTR | 0.8697 |
745 | BHO | 0.8697 |
746 | NPO | 0.8697 |
747 | 261 | 0.8697 |
748 | MQN | 0.8696 |
749 | AJ2 | 0.8695 |
750 | PE0 | 0.8695 |
751 | NMJ | 0.8695 |
752 | HMH | 0.8695 |
753 | TT4 | 0.8694 |
754 | JRB | 0.8693 |
755 | FEH | 0.8693 |
756 | IP0 | 0.8693 |
757 | GT0 | 0.8692 |
758 | E1P | 0.8691 |
759 | RM1 | 0.8691 |
760 | 0W8 | 0.8691 |
761 | GJP | 0.8690 |
762 | Q88 | 0.8690 |
763 | RIM | 0.8689 |
764 | XQK | 0.8689 |
765 | 4ZC | 0.8689 |
766 | CN0 | 0.8689 |
767 | 5WX | 0.8689 |
768 | 7FF | 0.8689 |
769 | H7Y | 0.8688 |
770 | M4S | 0.8686 |
771 | NLA | 0.8686 |
772 | SAL | 0.8686 |
773 | NIZ | 0.8686 |
774 | 3PF | 0.8686 |
775 | 7A8 | 0.8686 |
776 | A09 | 0.8686 |
777 | Q24 | 0.8685 |
778 | 4YO | 0.8685 |
779 | 3DM | 0.8683 |
780 | GYP | 0.8683 |
781 | SEP | 0.8683 |
782 | 53C | 0.8683 |
783 | ASP | 0.8683 |
784 | EHM | 0.8682 |
785 | D48 | 0.8682 |
786 | IF7 | 0.8682 |
787 | DYT | 0.8681 |
788 | DS0 | 0.8680 |
789 | E4P | 0.8680 |
790 | 3U4 | 0.8680 |
791 | K6H | 0.8679 |
792 | 12M | 0.8679 |
793 | MCO | 0.8679 |
794 | B2J | 0.8679 |
795 | KOJ | 0.8679 |
796 | CKU | 0.8678 |
797 | BEU | 0.8678 |
798 | P9P | 0.8678 |
799 | MEW | 0.8677 |
800 | MO8 | 0.8677 |
801 | SAN | 0.8677 |
802 | TGX | 0.8676 |
803 | SNE | 0.8676 |
804 | 4BY | 0.8675 |
805 | T9G | 0.8675 |
806 | MB1 | 0.8674 |
807 | 8OZ | 0.8672 |
808 | GF1 | 0.8671 |
809 | 7ME | 0.8670 |
810 | 9RW | 0.8670 |
811 | 2SX | 0.8669 |
812 | QX4 | 0.8668 |
813 | XYL | 0.8667 |
814 | PRY | 0.8667 |
815 | 5QX | 0.8667 |
816 | 1LN | 0.8666 |
817 | ZZ3 | 0.8666 |
818 | 4XV | 0.8665 |
819 | AL0 | 0.8665 |
820 | MWP | 0.8664 |
821 | BE2 | 0.8664 |
822 | IFP | 0.8664 |
823 | 4RU | 0.8663 |
824 | X0V | 0.8663 |
825 | NSP | 0.8662 |
826 | GDL | 0.8661 |
827 | 4MA | 0.8661 |
828 | RBL | 0.8661 |
829 | 4BL | 0.8660 |
830 | HBD | 0.8659 |
831 | RMN | 0.8658 |
832 | 5MB | 0.8657 |
833 | PZM | 0.8657 |
834 | AX3 | 0.8657 |
835 | 24B | 0.8657 |
836 | LTM | 0.8657 |
837 | G2F | 0.8657 |
838 | SHG | 0.8656 |
839 | PAF | 0.8655 |
840 | HHI | 0.8655 |
841 | NOK | 0.8655 |
842 | AHR | 0.8655 |
843 | EDR | 0.8654 |
844 | 4PW | 0.8653 |
845 | LRH | 0.8651 |
846 | 3SK | 0.8651 |
847 | 4FH | 0.8651 |
848 | M1H | 0.8650 |
849 | SKJ | 0.8650 |
850 | SD4 | 0.8650 |
851 | 4NC | 0.8649 |
852 | NTZ | 0.8649 |
853 | ECG | 0.8649 |
854 | FUL | 0.8649 |
855 | CHB | 0.8648 |
856 | BM3 | 0.8648 |
857 | MA3 | 0.8647 |
858 | EOL | 0.8647 |
859 | PBZ | 0.8647 |
860 | OGA | 0.8647 |
861 | ZB1 | 0.8646 |
862 | M1P | 0.8646 |
863 | 49N | 0.8645 |
864 | JWB | 0.8644 |
865 | CAM | 0.8644 |
866 | BSX | 0.8643 |
867 | NHG | 0.8643 |
868 | 790 | 0.8643 |
869 | 173 | 0.8643 |
870 | 94B | 0.8641 |
871 | D07 | 0.8641 |
872 | GCS | 0.8641 |
873 | EU7 | 0.8640 |
874 | 6J9 | 0.8640 |
875 | 57O | 0.8640 |
876 | 67X | 0.8640 |
877 | XCZ | 0.8639 |
878 | DJN | 0.8638 |
879 | SMN | 0.8638 |
880 | TNX | 0.8638 |
881 | 7MK | 0.8638 |
882 | WOO | 0.8638 |
883 | KBG | 0.8637 |
884 | XLS | 0.8637 |
885 | KIA | 0.8637 |
886 | ZZT | 0.8637 |
887 | P72 | 0.8636 |
888 | BZJ | 0.8636 |
889 | IOP | 0.8635 |
890 | YRL | 0.8635 |
891 | K5W | 0.8634 |
892 | N3W | 0.8633 |
893 | ISJ | 0.8633 |
894 | 3FH | 0.8633 |
895 | 2D3 | 0.8631 |
896 | TQU | 0.8631 |
897 | S24 | 0.8627 |
898 | EKZ | 0.8627 |
899 | GLL | 0.8627 |
900 | 1Y6 | 0.8626 |
901 | 3C4 | 0.8626 |
902 | PJL | 0.8626 |
903 | ONL | 0.8626 |
904 | GRO | 0.8624 |
905 | DQU | 0.8623 |
906 | 8GC | 0.8623 |
907 | 3BZ | 0.8623 |
908 | HBA | 0.8623 |
909 | FBW | 0.8622 |
910 | HC4 | 0.8622 |
911 | 93K | 0.8621 |
912 | 36E | 0.8621 |
913 | JZ4 | 0.8621 |
914 | M4T | 0.8620 |
915 | GJZ | 0.8619 |
916 | PXL | 0.8617 |
917 | 8SZ | 0.8617 |
918 | 9R5 | 0.8616 |
919 | 6M4 | 0.8616 |
920 | E7S | 0.8615 |
921 | SBK | 0.8613 |
922 | TRP | 0.8613 |
923 | VNJ | 0.8613 |
924 | 7MX | 0.8612 |
925 | 2HO | 0.8610 |
926 | 8WT | 0.8610 |
927 | S7J | 0.8609 |
928 | EN1 | 0.8606 |
929 | LR5 | 0.8606 |
930 | AOZ | 0.8606 |
931 | NBG | 0.8606 |
932 | HHA | 0.8606 |
933 | MYJ | 0.8605 |
934 | 9TW | 0.8605 |
935 | B57 | 0.8605 |
936 | NBB | 0.8604 |
937 | SWA | 0.8603 |
938 | AHN | 0.8601 |
939 | S3P | 0.8601 |
940 | QSB | 0.8600 |
941 | PXM | 0.8600 |
942 | GLN | 0.8600 |
943 | ICF | 0.8599 |
944 | LCN | 0.8598 |
945 | MZT | 0.8598 |
946 | BBK | 0.8598 |
947 | HQD | 0.8597 |
948 | GOJ | 0.8596 |
949 | 7QS | 0.8596 |
950 | CAH | 0.8596 |
951 | LT3 | 0.8596 |
952 | B5D | 0.8595 |
953 | TYL | 0.8594 |
954 | OSE | 0.8593 |
955 | AOT | 0.8593 |
956 | ALL | 0.8591 |
957 | TLM | 0.8590 |
958 | F52 | 0.8590 |
959 | 0FK | 0.8589 |
960 | AEF | 0.8588 |
961 | FBF | 0.8588 |
962 | UNJ | 0.8587 |
963 | 3DO | 0.8586 |
964 | JF4 | 0.8586 |
965 | 4XS | 0.8585 |
966 | IHB | 0.8584 |
967 | Z82 | 0.8584 |
968 | AEH | 0.8583 |
969 | VK3 | 0.8583 |
970 | RM4 | 0.8581 |
971 | MFB | 0.8580 |
972 | GIM | 0.8578 |
973 | 7I2 | 0.8578 |
974 | ZGL | 0.8578 |
975 | TSU | 0.8577 |
976 | L13 | 0.8576 |
977 | WCE | 0.8575 |
978 | EXD | 0.8575 |
979 | JND | 0.8574 |
980 | 7WG | 0.8572 |
981 | PAC | 0.8572 |
982 | YZM | 0.8571 |
983 | S0E | 0.8570 |
984 | 3ZB | 0.8570 |
985 | CNL | 0.8569 |
986 | JKE | 0.8569 |
987 | INF | 0.8569 |
988 | B62 | 0.8568 |
989 | Q07 | 0.8568 |
990 | CFA | 0.8567 |
991 | CTS | 0.8564 |
992 | 3C2 | 0.8564 |
993 | Z13 | 0.8563 |
994 | 2EH | 0.8562 |
995 | TL6 | 0.8562 |
996 | DTR | 0.8562 |
997 | 4VP | 0.8562 |
998 | 1WD | 0.8561 |
999 | ABV | 0.8558 |
1000 | 4JC | 0.8557 |
1001 | JF6 | 0.8557 |
1002 | 4HP | 0.8556 |
1003 | LYL | 0.8555 |
1004 | 6UA | 0.8553 |
1005 | 3XR | 0.8552 |
1006 | 2EC | 0.8552 |
1007 | FDR | 0.8551 |
1008 | PJW | 0.8550 |
1009 | RBJ | 0.8549 |
1010 | DFU | 0.8548 |
1011 | TNF | 0.8547 |
1012 | JTH | 0.8543 |
1013 | 3XX | 0.8543 |
1014 | E35 | 0.8541 |
1015 | AAN | 0.8539 |
1016 | 44V | 0.8538 |
1017 | G3P | 0.8538 |
1018 | 680 | 0.8537 |
1019 | 3C1 | 0.8535 |
1020 | MXN | 0.8534 |
1021 | TNE | 0.8534 |
1022 | KP6 | 0.8534 |
1023 | FCB | 0.8533 |
1024 | 4SX | 0.8528 |
1025 | 0P6 | 0.8523 |
1026 | HL4 | 0.8522 |
1027 | PPR | 0.8522 |
1028 | 308 | 0.8520 |
1029 | KG1 | 0.8517 |
1030 | 2XX | 0.8502 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | GSN | 0.9495 |
2 | MP2 | 0.9045 |
3 | ALA ALA ALA ALA | 0.8738 |
4 | GGL CYW GLY | 0.8570 |
5 | DN8 | 0.8566 |
This union binding pocket(no: 1) in the query (biounit: 1ss4.bio2) has 4 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1ss4.bio2) has 4 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1ss4.bio2) has 6 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 1ss4.bio2) has 6 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 1ss4.bio1) has 4 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 1ss4.bio1) has 6 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |