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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 4 families. | |||||
1 | 3HXX | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
2 | 3HXU | - | A5A | C13 H19 N7 O7 S | C[C@@H](C(.... |
3 | 3HXW | - | SSA | C13 H19 N7 O8 S | c1nc(c2c(n.... |
4 | 3HXZ | - | A5A | C13 H19 N7 O7 S | C[C@@H](C(.... |
5 | 3HXV | - | G5A | C12 H17 N7 O7 S | c1nc(c2c(n.... |
6 | 3HXY | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
7 | 3HY0 | - | G5A | C12 H17 N7 O7 S | c1nc(c2c(n.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 3HXX | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
2 | 3HXU | - | A5A | C13 H19 N7 O7 S | C[C@@H](C(.... |
3 | 3HXW | - | SSA | C13 H19 N7 O8 S | c1nc(c2c(n.... |
4 | 3HXZ | - | A5A | C13 H19 N7 O7 S | C[C@@H](C(.... |
5 | 3HXV | - | G5A | C12 H17 N7 O7 S | c1nc(c2c(n.... |
6 | 3HXY | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
7 | 3HY0 | - | G5A | C12 H17 N7 O7 S | c1nc(c2c(n.... |
8 | 5V59 | - | 8X1 | C14 H19 N7 O7 S | c1nc(c2c(n.... |
9 | 1YFS | - | ALA | C3 H7 N O2 | C[C@@H](C(.... |
10 | 1YGB | - | SER | C3 H7 N O3 | C([C@@H](C.... |
11 | 1YFT | - | GLY | C2 H5 N O2 | C(C(=O)O)N |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 5AL | 1 | 1 |
2 | 8LH | 0.873418 | 0.972603 |
3 | 8QN | 0.841463 | 1 |
4 | SRP | 0.82716 | 0.945946 |
5 | KG4 | 0.807692 | 0.958904 |
6 | CA0 | 0.794872 | 0.958904 |
7 | AMO | 0.788235 | 0.945946 |
8 | PAJ | 0.788235 | 0.922078 |
9 | 8LQ | 0.785714 | 0.972603 |
10 | ME8 | 0.772727 | 0.898734 |
11 | 4AD | 0.767442 | 0.933333 |
12 | QA7 | 0.764706 | 0.959459 |
13 | LAD | 0.761364 | 0.897436 |
14 | 8LE | 0.759036 | 0.959459 |
15 | A2D | 0.753247 | 0.931507 |
16 | NB8 | 0.752809 | 0.909091 |
17 | PTJ | 0.752809 | 0.934211 |
18 | AN2 | 0.7375 | 0.918919 |
19 | BA3 | 0.734177 | 0.931507 |
20 | M33 | 0.728395 | 0.945205 |
21 | FA5 | 0.728261 | 0.945946 |
22 | ADP | 0.725 | 0.931507 |
23 | B4P | 0.725 | 0.931507 |
24 | AP5 | 0.725 | 0.931507 |
25 | DLL | 0.719101 | 0.972222 |
26 | AT4 | 0.716049 | 0.894737 |
27 | TXA | 0.714286 | 0.972603 |
28 | AMP | 0.714286 | 0.930556 |
29 | A | 0.714286 | 0.930556 |
30 | PRX | 0.710843 | 0.906667 |
31 | 45A | 0.708861 | 0.931507 |
32 | ABM | 0.708861 | 0.931507 |
33 | ADX | 0.707317 | 0.839506 |
34 | HEJ | 0.698795 | 0.931507 |
35 | ATP | 0.698795 | 0.931507 |
36 | ACP | 0.698795 | 0.906667 |
37 | 50T | 0.698795 | 0.893333 |
38 | OOB | 0.696629 | 0.972222 |
39 | YLP | 0.693878 | 0.876543 |
40 | AR6 | 0.690476 | 0.958333 |
41 | AQP | 0.690476 | 0.931507 |
42 | APR | 0.690476 | 0.958333 |
43 | 5FA | 0.690476 | 0.931507 |
44 | DAL AMP | 0.685393 | 0.972222 |
45 | PR8 | 0.684783 | 0.886076 |
46 | AMP MG | 0.683544 | 0.916667 |
47 | AGS | 0.682353 | 0.883117 |
48 | AD9 | 0.682353 | 0.906667 |
49 | 00A | 0.681319 | 0.921053 |
50 | AHX | 0.681319 | 0.884615 |
51 | 9ZD | 0.677778 | 0.946667 |
52 | 9ZA | 0.677778 | 0.946667 |
53 | 1ZZ | 0.677419 | 0.898734 |
54 | SON | 0.674699 | 0.945946 |
55 | 3UK | 0.673913 | 0.958904 |
56 | YLB | 0.673267 | 0.876543 |
57 | YLC | 0.673267 | 0.898734 |
58 | AP2 | 0.670732 | 0.894737 |
59 | A12 | 0.670732 | 0.894737 |
60 | ANP | 0.666667 | 0.906667 |
61 | ACQ | 0.666667 | 0.906667 |
62 | WAQ | 0.666667 | 0.921053 |
63 | B5V | 0.666667 | 0.945946 |
64 | TYM | 0.663366 | 0.945946 |
65 | SRA | 0.6625 | 0.881579 |
66 | B5Y | 0.65625 | 0.959459 |
67 | B5M | 0.65625 | 0.959459 |
68 | OAD | 0.655914 | 0.986111 |
69 | A1R | 0.652174 | 0.871795 |
70 | ATF | 0.651685 | 0.894737 |
71 | GAP | 0.647727 | 0.932432 |
72 | AYB | 0.647619 | 0.865854 |
73 | AU1 | 0.647059 | 0.906667 |
74 | 9SN | 0.645833 | 0.909091 |
75 | 6YZ | 0.644444 | 0.906667 |
76 | 4UV | 0.642857 | 0.933333 |
77 | 3OD | 0.642105 | 0.986111 |
78 | 5SV | 0.641304 | 0.860759 |
79 | V2G | 0.640449 | 0.909091 |
80 | 9X8 | 0.638298 | 0.933333 |
81 | YLA | 0.638095 | 0.853659 |
82 | HQG | 0.637363 | 0.945205 |
83 | ADP MG | 0.635294 | 0.930556 |
84 | ADP BEF | 0.635294 | 0.930556 |
85 | A5A | 0.633333 | 0.841463 |
86 | XAH | 0.632653 | 0.851852 |
87 | APC | 0.632184 | 0.894737 |
88 | A22 | 0.630435 | 0.918919 |
89 | 4UU | 0.63 | 0.933333 |
90 | T99 | 0.629214 | 0.894737 |
91 | TAT | 0.629214 | 0.894737 |
92 | JNT | 0.62766 | 0.906667 |
93 | FYA | 0.625 | 0.893333 |
94 | RBY | 0.625 | 0.92 |
95 | ADV | 0.625 | 0.92 |
96 | 25A | 0.623656 | 0.931507 |
97 | OZV | 0.623656 | 0.931507 |
98 | 4UW | 0.621359 | 0.922078 |
99 | ADQ | 0.617021 | 0.932432 |
100 | A3R | 0.617021 | 0.871795 |
101 | TSB | 0.612903 | 0.831325 |
102 | 48N | 0.61165 | 0.934211 |
103 | YLY | 0.607143 | 0.865854 |
104 | ADP PO3 | 0.606742 | 0.930556 |
105 | APC MG | 0.606742 | 0.905405 |
106 | ATP MG | 0.606742 | 0.930556 |
107 | VMS | 0.602151 | 0.821429 |
108 | 54H | 0.602151 | 0.821429 |
109 | LAQ | 0.601942 | 0.875 |
110 | BEF ADP | 0.6 | 0.905405 |
111 | GA7 | 0.598039 | 0.894737 |
112 | DQV | 0.592233 | 0.945205 |
113 | BIS | 0.591837 | 0.871795 |
114 | LMS | 0.590361 | 0.817073 |
115 | KMQ | 0.59 | 0.945946 |
116 | MYR AMP | 0.585859 | 0.875 |
117 | 25L | 0.585859 | 0.918919 |
118 | IOT | 0.583333 | 0.843373 |
119 | LSS | 0.583333 | 0.793103 |
120 | ANP MG | 0.580645 | 0.918919 |
121 | VO4 ADP | 0.580645 | 0.906667 |
122 | ALF ADP | 0.580645 | 0.858974 |
123 | AP0 | 0.579439 | 0.884615 |
124 | 53H | 0.578947 | 0.811765 |
125 | MAP | 0.578947 | 0.883117 |
126 | N0B | 0.577586 | 0.853659 |
127 | NAI | 0.575472 | 0.896104 |
128 | TXD | 0.575472 | 0.896104 |
129 | SSA | 0.574468 | 0.790698 |
130 | G3A | 0.572816 | 0.884615 |
131 | OMR | 0.570093 | 0.8875 |
132 | TXE | 0.570093 | 0.896104 |
133 | 52H | 0.568421 | 0.811765 |
134 | 5AS | 0.568182 | 0.790698 |
135 | F2R | 0.567568 | 0.853659 |
136 | G5P | 0.567308 | 0.884615 |
137 | AFH | 0.567308 | 0.873418 |
138 | ARG AMP | 0.567308 | 0.841463 |
139 | L3W | 0.564815 | 0.92 |
140 | 5CA | 0.5625 | 0.790698 |
141 | GTA | 0.561905 | 0.875 |
142 | NAX | 0.560748 | 0.8625 |
143 | DND | 0.560748 | 0.945946 |
144 | 6V0 | 0.560748 | 0.884615 |
145 | 2A5 | 0.56044 | 0.857143 |
146 | XYA | 0.558442 | 0.808219 |
147 | RAB | 0.558442 | 0.808219 |
148 | ADN | 0.558442 | 0.808219 |
149 | AOC | 0.55814 | 0.810811 |
150 | 5CD | 0.556962 | 0.794521 |
151 | LEU LMS | 0.555556 | 0.781609 |
152 | 80F | 0.552632 | 0.853659 |
153 | 7MD | 0.552381 | 0.875 |
154 | DSZ | 0.55102 | 0.811765 |
155 | COD | 0.548673 | 0.823529 |
156 | G5A | 0.548387 | 0.790698 |
157 | TAD | 0.54717 | 0.873418 |
158 | NVA LMS | 0.545455 | 0.784091 |
159 | CNA | 0.544643 | 0.92 |
160 | JB6 | 0.544554 | 0.871795 |
161 | 5N5 | 0.544304 | 0.783784 |
162 | BT5 | 0.54386 | 0.843373 |
163 | ADP BMA | 0.54 | 0.906667 |
164 | M24 | 0.538462 | 0.886076 |
165 | A4D | 0.5375 | 0.783784 |
166 | EP4 | 0.536585 | 0.766234 |
167 | T5A | 0.535714 | 0.853659 |
168 | 7D5 | 0.535714 | 0.842105 |
169 | NSS | 0.535354 | 0.790698 |
170 | KAA | 0.534653 | 0.764045 |
171 | GSU | 0.534653 | 0.811765 |
172 | D4F | 0.533898 | 0.875 |
173 | AMP DBH | 0.533333 | 0.881579 |
174 | 5X8 | 0.532609 | 0.8 |
175 | UP5 | 0.53211 | 0.907895 |
176 | 8X1 | 0.530612 | 0.764045 |
177 | M2T | 0.53012 | 0.746835 |
178 | DTA | 0.53012 | 0.776316 |
179 | 9K8 | 0.529412 | 0.764045 |
180 | 3DH | 0.529412 | 0.786667 |
181 | NAQ | 0.529412 | 0.909091 |
182 | 7D3 | 0.52809 | 0.844156 |
183 | AHZ | 0.527778 | 0.875 |
184 | ALF ADP 3PG | 0.527273 | 0.873418 |
185 | AF3 ADP 3PG | 0.527273 | 0.873418 |
186 | A3D | 0.525862 | 0.958904 |
187 | SMM | 0.525773 | 0.738095 |
188 | MTA | 0.52381 | 0.786667 |
189 | YSA | 0.52381 | 0.790698 |
190 | LPA AMP | 0.522936 | 0.851852 |
191 | UPA | 0.522523 | 0.896104 |
192 | 4TC | 0.522523 | 0.884615 |
193 | 7MC | 0.522523 | 0.876543 |
194 | A3P | 0.522222 | 0.930556 |
195 | ADJ | 0.522124 | 0.841463 |
196 | NAD | 0.521739 | 0.945205 |
197 | 7D4 | 0.521739 | 0.844156 |
198 | ATR | 0.521277 | 0.90411 |
199 | PAP | 0.521277 | 0.917808 |
200 | SA8 | 0.521277 | 0.7625 |
201 | EEM | 0.520833 | 0.743902 |
202 | P5A | 0.519608 | 0.755556 |
203 | A4P | 0.517857 | 0.811765 |
204 | SFG | 0.516129 | 0.786667 |
205 | H1Q | 0.516129 | 0.891892 |
206 | ATP A | 0.514286 | 0.917808 |
207 | ATP A A A | 0.514286 | 0.917808 |
208 | 6RE | 0.511364 | 0.728395 |
209 | SAM | 0.510417 | 0.743902 |
210 | 139 | 0.508772 | 0.8625 |
211 | NAE | 0.508333 | 0.933333 |
212 | 3AM | 0.505747 | 0.890411 |
213 | A2P | 0.505495 | 0.916667 |
214 | ITT | 0.505376 | 0.878378 |
215 | PPS | 0.505155 | 0.817073 |
216 | 6AD | 0.505155 | 0.873418 |
217 | A2R | 0.50505 | 0.945205 |
218 | DZD | 0.504274 | 0.873418 |
219 | EAD | 0.504065 | 0.886076 |
220 | ZID | 0.5 | 0.932432 |
221 | SAI | 0.5 | 0.769231 |
222 | ARU | 0.5 | 0.82716 |
223 | SAH | 0.5 | 0.779221 |
224 | NWW | 0.5 | 0.75 |
225 | A3T | 0.5 | 0.835616 |
226 | 8PZ | 0.5 | 0.790698 |
227 | J7C | 0.5 | 0.7375 |
228 | BTX | 0.495726 | 0.831325 |
229 | NAD IBO | 0.495575 | 0.931507 |
230 | NAD TDB | 0.495575 | 0.931507 |
231 | AR6 AR6 | 0.495413 | 0.931507 |
232 | S7M | 0.494949 | 0.743902 |
233 | S4M | 0.494505 | 0.678161 |
234 | 6MZ | 0.494505 | 0.917808 |
235 | FB0 | 0.492188 | 0.795455 |
236 | J4G | 0.490385 | 0.933333 |
237 | MAO | 0.48913 | 0.771084 |
238 | P1H | 0.488189 | 0.864198 |
239 | WSA | 0.486726 | 0.8 |
240 | HFD | 0.484536 | 0.883117 |
241 | JSQ | 0.484536 | 0.883117 |
242 | IMO | 0.483516 | 0.890411 |
243 | A3N | 0.483516 | 0.753247 |
244 | NAJ PZO | 0.483333 | 0.860759 |
245 | ZAS | 0.483146 | 0.75641 |
246 | AMP NAD | 0.483051 | 0.945205 |
247 | KOY | 0.482143 | 0.84 |
248 | GEK | 0.480392 | 0.772152 |
249 | 6IA | 0.479592 | 0.82716 |
250 | V3L | 0.479592 | 0.958333 |
251 | A3S | 0.478723 | 0.8 |
252 | GJV | 0.478261 | 0.719512 |
253 | 2AM | 0.477273 | 0.878378 |
254 | NDE | 0.476562 | 0.92 |
255 | 0UM | 0.475728 | 0.753086 |
256 | NO7 | 0.475248 | 0.87013 |
257 | 5AD | 0.475 | 0.760563 |
258 | 7C5 | 0.472727 | 0.831169 |
259 | A3G | 0.472527 | 0.789474 |
260 | NEC | 0.472527 | 0.76 |
261 | DSH | 0.472527 | 0.716049 |
262 | 62X | 0.471154 | 0.717647 |
263 | 2SA | 0.47 | 0.92 |
264 | O02 | 0.469388 | 0.860759 |
265 | CUU | 0.46875 | 0.905405 |
266 | 2VA | 0.46875 | 0.813333 |
267 | B1U | 0.46789 | 0.747253 |
268 | NAJ PYZ | 0.467742 | 0.819277 |
269 | K15 | 0.466667 | 0.73494 |
270 | NA7 | 0.466667 | 0.894737 |
271 | 3AT | 0.464646 | 0.905405 |
272 | A7D | 0.463158 | 0.766234 |
273 | NJP | 0.462185 | 0.907895 |
274 | OVE | 0.461538 | 0.844156 |
275 | NWQ | 0.460674 | 0.753425 |
276 | FNK | 0.459854 | 0.795455 |
277 | A5D | 0.459184 | 0.776316 |
278 | MHZ | 0.458333 | 0.709302 |
279 | 4TA | 0.458333 | 0.841463 |
280 | 0WD | 0.458333 | 0.884615 |
281 | NDC | 0.458015 | 0.884615 |
282 | SXZ | 0.457944 | 0.765432 |
283 | 8Q2 | 0.456897 | 0.764045 |
284 | AV2 | 0.455446 | 0.855263 |
285 | SO8 | 0.454545 | 0.802632 |
286 | DAT | 0.453608 | 0.844156 |
287 | 38V | 0.452381 | 0.851852 |
288 | Y3J | 0.452381 | 0.716216 |
289 | AVV | 0.451923 | 0.860759 |
290 | QXP | 0.451923 | 0.755814 |
291 | 4YB | 0.451327 | 0.793103 |
292 | 7D7 | 0.451219 | 0.733333 |
293 | FDA | 0.451128 | 0.823529 |
294 | V47 | 0.45098 | 0.821918 |
295 | DTP | 0.45 | 0.844156 |
296 | AMZ | 0.449438 | 0.878378 |
297 | C2R | 0.449438 | 0.891892 |
298 | 6FA | 0.447761 | 0.853659 |
299 | AAT | 0.445545 | 0.698795 |
300 | K3K | 0.445455 | 0.769231 |
301 | NDP | 0.445378 | 0.884615 |
302 | NVA 2AD | 0.444444 | 0.772152 |
303 | PGS | 0.443299 | 0.825 |
304 | GGZ | 0.442308 | 0.792683 |
305 | 71V | 0.442105 | 0.848101 |
306 | TXP | 0.441667 | 0.884615 |
307 | NZQ | 0.441667 | 0.873418 |
308 | LQJ | 0.441441 | 0.905405 |
309 | FAD | 0.441176 | 0.864198 |
310 | FAS | 0.441176 | 0.864198 |
311 | SFD | 0.441176 | 0.744681 |
312 | N5O | 0.44086 | 0.753247 |
313 | KB1 | 0.440367 | 0.731707 |
314 | 6C6 | 0.44 | 0.846154 |
315 | VRT | 0.44 | 0.782051 |
316 | QXG | 0.439252 | 0.747126 |
317 | KXW | 0.438596 | 0.740741 |
318 | KH3 | 0.438596 | 0.72619 |
319 | ODP | 0.438017 | 0.873418 |
320 | K3E | 0.4375 | 0.759494 |
321 | 649 | 0.435897 | 0.755556 |
322 | R2V | 0.435185 | 0.755814 |
323 | 3NZ | 0.435185 | 0.794872 |
324 | NPW | 0.433333 | 0.851852 |
325 | ETB | 0.432 | 0.823529 |
326 | DCA | 0.432 | 0.813953 |
327 | N5A | 0.431579 | 0.727273 |
328 | OZP | 0.431034 | 0.7625 |
329 | N6P | 0.429907 | 0.876712 |
330 | K2H | 0.429907 | 0.746835 |
331 | 62F | 0.428571 | 0.851852 |
332 | KYE | 0.428571 | 0.72619 |
333 | D3Y | 0.428571 | 0.779221 |
334 | COS | 0.426357 | 0.795455 |
335 | Z5A | 0.426357 | 0.811765 |
336 | A6D | 0.425926 | 0.714286 |
337 | PO4 PO4 A A A A PO4 | 0.425926 | 0.890411 |
338 | DA | 0.425532 | 0.842105 |
339 | D5M | 0.425532 | 0.842105 |
340 | FAY | 0.425532 | 0.875 |
341 | COA | 0.425197 | 0.813953 |
342 | 0T1 | 0.425197 | 0.813953 |
343 | P5F | 0.424658 | 0.835294 |
344 | S8M | 0.424528 | 0.75 |
345 | 6K6 | 0.424528 | 0.891892 |
346 | NIA | 0.423913 | 0.790123 |
347 | RFL | 0.422535 | 0.833333 |
348 | K2K | 0.422018 | 0.707317 |
349 | YZS | 0.421053 | 0.721649 |
350 | KGP | 0.421053 | 0.721649 |
351 | FAI | 0.421053 | 0.878378 |
352 | AAM | 0.421053 | 0.930556 |
353 | Q34 | 0.420168 | 0.705882 |
354 | F2N | 0.418919 | 0.804598 |
355 | 7DD | 0.418367 | 0.917808 |
356 | K2R | 0.418182 | 0.893333 |
357 | DAL FAD PER | 0.416107 | 0.777778 |
358 | DG1 | 0.415385 | 0.884615 |
359 | CAO | 0.415385 | 0.786517 |
360 | 1DG | 0.415385 | 0.884615 |
361 | AMX | 0.415385 | 0.823529 |
362 | 30N | 0.415385 | 0.744681 |
363 | KY2 | 0.415094 | 0.702381 |
364 | V1N | 0.412281 | 0.931507 |
365 | SCO | 0.412214 | 0.835294 |
366 | NA0 | 0.412214 | 0.945946 |
367 | CMX | 0.412214 | 0.835294 |
368 | Q2P | 0.41129 | 0.705882 |
369 | XNP | 0.41129 | 0.839506 |
370 | 9JJ | 0.410959 | 0.851852 |
371 | 7RP | 0.410526 | 0.888889 |
372 | MCD | 0.410448 | 0.816092 |
373 | HZ2 | 0.410256 | 0.743902 |
374 | FCX | 0.409091 | 0.806818 |
375 | 26A | 0.409091 | 0.753247 |
376 | ACO | 0.409091 | 0.786517 |
377 | FAM | 0.409091 | 0.795455 |
378 | AIR | 0.409091 | 0.863014 |
379 | LCV | 0.408759 | 0.731959 |
380 | SO5 | 0.408759 | 0.731959 |
381 | F0P | 0.408333 | 0.7625 |
382 | Q2M | 0.408333 | 0.722892 |
383 | NX8 | 0.407767 | 0.707317 |
384 | DDS | 0.407767 | 0.818182 |
385 | NAP | 0.407692 | 0.932432 |
386 | KYB | 0.407407 | 0.702381 |
387 | CO6 | 0.407407 | 0.795455 |
388 | RGT | 0.40708 | 0.92 |
389 | FA9 | 0.406667 | 0.853659 |
390 | HAX | 0.406015 | 0.795455 |
391 | 7DT | 0.405941 | 0.917808 |
392 | O05 | 0.405405 | 0.790698 |
393 | ANZ | 0.405172 | 0.768293 |
394 | APU | 0.404959 | 0.883117 |
395 | J7V | 0.40458 | 0.845238 |
396 | 2MC | 0.404412 | 0.76087 |
397 | NAD BBN | 0.404255 | 0.831325 |
398 | GNH | 0.403846 | 0.871795 |
399 | K3H | 0.403509 | 0.740741 |
400 | K2W | 0.403509 | 0.710843 |
401 | EU9 | 0.403361 | 0.715909 |
402 | HY8 | 0.403361 | 0.743902 |
403 | FYN | 0.402985 | 0.813953 |
404 | 3KK | 0.402985 | 0.795455 |
405 | KY5 | 0.401786 | 0.716049 |
406 | PLP AAD | 0.401575 | 0.744444 |
407 | SLU | 0.401575 | 0.781609 |
408 | N01 | 0.401575 | 0.945205 |
409 | 7L1 | 0.401515 | 0.786517 |
410 | A1S | 0.40146 | 0.795455 |
411 | IVC | 0.40146 | 0.804598 |
412 | 3HC | 0.40146 | 0.804598 |
413 | FAJ | 0.401316 | 0.843373 |
414 | COK | 0.4 | 0.795455 |
415 | 101 | 0.4 | 0.842105 |
416 | N37 | 0.4 | 0.769231 |
417 | SOP | 0.4 | 0.795455 |
418 | OXK | 0.4 | 0.816092 |
419 | NMN AMP PO4 | 0.4 | 0.883117 |
420 | CA6 | 0.4 | 0.721649 |
421 | NHD | 0.4 | 0.918919 |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | ACP | 1 | 1 |
2 | ACQ | 0.866667 | 1 |
3 | A2D | 0.857143 | 0.945205 |
4 | 6YZ | 0.833333 | 1 |
5 | BA3 | 0.833333 | 0.945205 |
6 | B4P | 0.821918 | 0.945205 |
7 | AP5 | 0.821918 | 0.945205 |
8 | ADP | 0.821918 | 0.972222 |
9 | AT4 | 0.810811 | 0.933333 |
10 | AN2 | 0.810811 | 0.958904 |
11 | A12 | 0.808219 | 0.986301 |
12 | AP2 | 0.808219 | 0.986301 |
13 | M33 | 0.8 | 0.932432 |
14 | HEJ | 0.789474 | 0.972222 |
15 | ATP | 0.789474 | 0.972222 |
16 | AR6 | 0.779221 | 0.945205 |
17 | 5FA | 0.779221 | 0.972222 |
18 | APR | 0.779221 | 0.945205 |
19 | AQP | 0.779221 | 0.972222 |
20 | AGS | 0.769231 | 0.921053 |
21 | AD9 | 0.769231 | 0.945946 |
22 | AMP | 0.763889 | 0.944444 |
23 | A | 0.763889 | 0.944444 |
24 | APC | 0.75641 | 0.986301 |
25 | ADX | 0.753247 | 0.851852 |
26 | CA0 | 0.753247 | 0.92 |
27 | ANP | 0.75 | 0.945946 |
28 | KG4 | 0.74359 | 0.92 |
29 | 50T | 0.74359 | 0.932432 |
30 | PRX | 0.734177 | 0.87013 |
31 | ABM | 0.733333 | 0.893333 |
32 | 45A | 0.733333 | 0.893333 |
33 | ATF | 0.731707 | 0.933333 |
34 | AMP MG | 0.72973 | 0.90411 |
35 | HQG | 0.714286 | 0.958904 |
36 | SRA | 0.706667 | 0.894737 |
37 | A22 | 0.705882 | 0.958904 |
38 | RBY | 0.703704 | 0.959459 |
39 | ADV | 0.703704 | 0.959459 |
40 | 5AL | 0.698795 | 0.906667 |
41 | 8LE | 0.698795 | 0.871795 |
42 | ADP BEF | 0.696203 | 0.917808 |
43 | ADP MG | 0.696203 | 0.917808 |
44 | A3R | 0.689655 | 0.909091 |
45 | ADQ | 0.689655 | 0.92 |
46 | A1R | 0.689655 | 0.909091 |
47 | AU1 | 0.6875 | 0.945946 |
48 | T99 | 0.686747 | 0.933333 |
49 | TAT | 0.686747 | 0.933333 |
50 | APC MG | 0.682927 | 0.918919 |
51 | SRP | 0.682353 | 0.907895 |
52 | 8LH | 0.682353 | 0.883117 |
53 | JNT | 0.681818 | 0.945946 |
54 | OAD | 0.674157 | 0.92 |
55 | 9X8 | 0.674157 | 0.896104 |
56 | 4TC | 0.673469 | 0.922078 |
57 | 4AD | 0.670455 | 0.921053 |
58 | AMO | 0.670455 | 0.933333 |
59 | 8LQ | 0.666667 | 0.907895 |
60 | QA7 | 0.666667 | 0.871795 |
61 | 00A | 0.662921 | 0.860759 |
62 | ADP PO3 | 0.662651 | 0.917808 |
63 | ATP MG | 0.662651 | 0.917808 |
64 | 3OD | 0.659341 | 0.92 |
65 | BIS | 0.659341 | 0.909091 |
66 | OOB | 0.659091 | 0.906667 |
67 | 5SV | 0.659091 | 0.82716 |
68 | 25A | 0.659091 | 0.945205 |
69 | 8QN | 0.659091 | 0.906667 |
70 | OZV | 0.659091 | 0.945205 |
71 | BEF ADP | 0.654762 | 0.893333 |
72 | SON | 0.654321 | 0.933333 |
73 | 25L | 0.652174 | 0.958904 |
74 | PAJ | 0.651685 | 0.8625 |
75 | AHX | 0.644444 | 0.897436 |
76 | DLL | 0.644444 | 0.906667 |
77 | TXA | 0.641304 | 0.907895 |
78 | V2G | 0.639535 | 0.897436 |
79 | KMQ | 0.638298 | 0.907895 |
80 | 3UK | 0.637363 | 0.894737 |
81 | VO4 ADP | 0.632184 | 0.92 |
82 | ANP MG | 0.632184 | 0.906667 |
83 | ALF ADP | 0.632184 | 0.848101 |
84 | B5V | 0.630435 | 0.883117 |
85 | PR8 | 0.630435 | 0.851852 |
86 | LAD | 0.630435 | 0.8625 |
87 | WAQ | 0.630435 | 0.884615 |
88 | MAP | 0.629214 | 0.921053 |
89 | LMS | 0.628205 | 0.807229 |
90 | GAP | 0.627907 | 0.87013 |
91 | ME8 | 0.623656 | 0.841463 |
92 | 1ZZ | 0.623656 | 0.819277 |
93 | PTJ | 0.623656 | 0.873418 |
94 | NB8 | 0.623656 | 0.897436 |
95 | FYA | 0.623656 | 0.906667 |
96 | UP5 | 0.62 | 0.896104 |
97 | G3A | 0.618557 | 0.897436 |
98 | AFH | 0.612245 | 0.886076 |
99 | G5P | 0.612245 | 0.897436 |
100 | 9SN | 0.610526 | 0.85 |
101 | DQV | 0.606061 | 0.932432 |
102 | GTA | 0.606061 | 0.864198 |
103 | 9ZA | 0.604396 | 0.884615 |
104 | 9ZD | 0.604396 | 0.884615 |
105 | B5M | 0.604167 | 0.871795 |
106 | FA5 | 0.604167 | 0.907895 |
107 | B5Y | 0.604167 | 0.871795 |
108 | TXD | 0.60396 | 0.884615 |
109 | XAH | 0.597938 | 0.841463 |
110 | RAB | 0.597222 | 0.821918 |
111 | ADN | 0.597222 | 0.821918 |
112 | XYA | 0.597222 | 0.821918 |
113 | GA7 | 0.59596 | 0.907895 |
114 | 48N | 0.594059 | 0.897436 |
115 | DAL AMP | 0.593407 | 0.881579 |
116 | 2A5 | 0.593023 | 0.92 |
117 | AOC | 0.592593 | 0.8 |
118 | 4UV | 0.591837 | 0.871795 |
119 | DND | 0.588235 | 0.907895 |
120 | NAI | 0.588235 | 0.884615 |
121 | 6V0 | 0.588235 | 0.873418 |
122 | NAX | 0.588235 | 0.875 |
123 | PAP | 0.586207 | 0.958333 |
124 | ATR | 0.586207 | 0.944444 |
125 | ADP BMA | 0.585106 | 0.894737 |
126 | LAQ | 0.584158 | 0.819277 |
127 | 5AS | 0.583333 | 0.761364 |
128 | TXE | 0.582524 | 0.884615 |
129 | OMR | 0.582524 | 0.831325 |
130 | 5N5 | 0.581081 | 0.797297 |
131 | 4UU | 0.58 | 0.871795 |
132 | 7D3 | 0.578313 | 0.881579 |
133 | AP0 | 0.576923 | 0.873418 |
134 | L3W | 0.576923 | 0.907895 |
135 | A4D | 0.573333 | 0.797297 |
136 | 5CD | 0.573333 | 0.783784 |
137 | JB6 | 0.572917 | 0.884615 |
138 | 4UW | 0.572816 | 0.839506 |
139 | A4P | 0.571429 | 0.823529 |
140 | CNA | 0.570093 | 0.907895 |
141 | ITT | 0.569767 | 0.917808 |
142 | 7D4 | 0.569767 | 0.881579 |
143 | A2R | 0.565217 | 0.958904 |
144 | M2T | 0.564103 | 0.716049 |
145 | YLP | 0.563107 | 0.821429 |
146 | O02 | 0.561798 | 0.947368 |
147 | T5A | 0.560748 | 0.843373 |
148 | ADJ | 0.560748 | 0.831325 |
149 | 139 | 0.560748 | 0.851852 |
150 | TAD | 0.558824 | 0.910256 |
151 | ATP A A A | 0.555556 | 0.905405 |
152 | ATP A | 0.555556 | 0.905405 |
153 | A3P | 0.552941 | 0.944444 |
154 | TYM | 0.552381 | 0.907895 |
155 | IOT | 0.551402 | 0.833333 |
156 | EP4 | 0.551282 | 0.734177 |
157 | MYR AMP | 0.55102 | 0.797619 |
158 | F2R | 0.550459 | 0.865854 |
159 | 7D5 | 0.55 | 0.855263 |
160 | 80F | 0.54955 | 0.843373 |
161 | A3D | 0.54955 | 0.894737 |
162 | GCP | 0.548387 | 0.922078 |
163 | YLC | 0.54717 | 0.841463 |
164 | YLB | 0.54717 | 0.821429 |
165 | UPA | 0.54717 | 0.884615 |
166 | COD | 0.545455 | 0.813953 |
167 | H1Q | 0.545455 | 0.88 |
168 | NAD | 0.545455 | 0.906667 |
169 | JSQ | 0.544444 | 0.921053 |
170 | G5A | 0.544444 | 0.781609 |
171 | HFD | 0.544444 | 0.921053 |
172 | DTA | 0.544304 | 0.766234 |
173 | 3DH | 0.54321 | 0.753247 |
174 | DZD | 0.540541 | 0.910256 |
175 | AHZ | 0.538462 | 0.797619 |
176 | MTA | 0.5375 | 0.753247 |
177 | 3AM | 0.536585 | 0.90411 |
178 | A2P | 0.534884 | 0.930556 |
179 | AR6 AR6 | 0.533981 | 0.893333 |
180 | PPS | 0.532609 | 0.851852 |
181 | 6AD | 0.532609 | 0.886076 |
182 | YLA | 0.53211 | 0.821429 |
183 | AMP DBH | 0.529412 | 0.87013 |
184 | AYB | 0.527273 | 0.811765 |
185 | A5A | 0.526882 | 0.788235 |
186 | TSB | 0.526316 | 0.8 |
187 | 6RE | 0.52381 | 0.7625 |
188 | S4M | 0.523256 | 0.670455 |
189 | 38V | 0.521368 | 0.911392 |
190 | SSA | 0.521277 | 0.802326 |
191 | NA7 | 0.520408 | 0.959459 |
192 | 7MD | 0.519231 | 0.864198 |
193 | ARG AMP | 0.519231 | 0.831325 |
194 | LPA AMP | 0.518868 | 0.797619 |
195 | BTX | 0.517857 | 0.843373 |
196 | NAE | 0.517241 | 0.871795 |
197 | 52H | 0.515789 | 0.761364 |
198 | VMS | 0.515789 | 0.770115 |
199 | NO7 | 0.515789 | 0.907895 |
200 | 54H | 0.515789 | 0.770115 |
201 | BT5 | 0.513274 | 0.833333 |
202 | NAQ | 0.512821 | 0.85 |
203 | ZAS | 0.511905 | 0.746835 |
204 | A3N | 0.511628 | 0.766234 |
205 | IMO | 0.511628 | 0.90411 |
206 | J7C | 0.511628 | 0.772152 |
207 | CUU | 0.511111 | 0.972222 |
208 | AV2 | 0.510638 | 0.893333 |
209 | 53H | 0.510417 | 0.761364 |
210 | 5CA | 0.510417 | 0.802326 |
211 | 8X1 | 0.510417 | 0.755556 |
212 | ARU | 0.510204 | 0.839506 |
213 | AF3 ADP 3PG | 0.509259 | 0.839506 |
214 | ALF ADP 3PG | 0.509259 | 0.839506 |
215 | M24 | 0.508621 | 0.829268 |
216 | ZID | 0.508475 | 0.894737 |
217 | 2AM | 0.506024 | 0.917808 |
218 | 6MZ | 0.505747 | 0.905405 |
219 | V3L | 0.505376 | 0.945205 |
220 | 3AT | 0.505376 | 0.972222 |
221 | AVV | 0.505155 | 0.897436 |
222 | NAD TDB | 0.504587 | 0.893333 |
223 | NAD IBO | 0.504587 | 0.893333 |
224 | DSZ | 0.5 | 0.802326 |
225 | EAD | 0.5 | 0.851852 |
226 | MAO | 0.5 | 0.761905 |
227 | NSS | 0.5 | 0.802326 |
228 | P5A | 0.5 | 0.747253 |
229 | DSH | 0.5 | 0.728395 |
230 | LSS | 0.5 | 0.764045 |
231 | YLY | 0.495726 | 0.811765 |
232 | 9K8 | 0.49505 | 0.698925 |
233 | NVA LMS | 0.494949 | 0.755556 |
234 | DAT | 0.494505 | 0.906667 |
235 | 5X8 | 0.494505 | 0.766234 |
236 | NWW | 0.493671 | 0.739726 |
237 | D4F | 0.491525 | 0.819277 |
238 | AMP NAD | 0.491228 | 0.881579 |
239 | 7MC | 0.490909 | 0.843373 |
240 | LEU LMS | 0.49 | 0.733333 |
241 | SMM | 0.489583 | 0.689655 |
242 | DTP | 0.489362 | 0.906667 |
243 | SAM | 0.489362 | 0.694118 |
244 | 7DD | 0.488889 | 0.958333 |
245 | GJV | 0.488636 | 0.753086 |
246 | OVE | 0.488372 | 0.881579 |
247 | 5AD | 0.486842 | 0.726027 |
248 | GSU | 0.485149 | 0.781609 |
249 | KAA | 0.485149 | 0.755556 |
250 | P1H | 0.483871 | 0.831325 |
251 | NDE | 0.483871 | 0.907895 |
252 | N0B | 0.483333 | 0.821429 |
253 | A3G | 0.482759 | 0.802632 |
254 | O05 | 0.480392 | 0.86747 |
255 | NAJ PZO | 0.478632 | 0.82716 |
256 | SFG | 0.478261 | 0.753247 |
257 | 4TA | 0.478261 | 0.809524 |
258 | NDC | 0.47619 | 0.85 |
259 | YSA | 0.47619 | 0.781609 |
260 | FB0 | 0.47619 | 0.827586 |
261 | 7DT | 0.473118 | 0.958333 |
262 | A7D | 0.472527 | 0.779221 |
263 | J4G | 0.470588 | 0.921053 |
264 | NJP | 0.469565 | 0.921053 |
265 | FDA | 0.46875 | 0.835294 |
266 | SA8 | 0.468085 | 0.710843 |
267 | A5D | 0.468085 | 0.766234 |
268 | MHZ | 0.467391 | 0.701149 |
269 | K3K | 0.466667 | 0.782051 |
270 | 8PZ | 0.466667 | 0.802326 |
271 | 71V | 0.466667 | 0.884615 |
272 | 0WD | 0.465517 | 0.897436 |
273 | 6FA | 0.465116 | 0.843373 |
274 | GGZ | 0.464646 | 0.804878 |
275 | SAI | 0.463158 | 0.7375 |
276 | SAH | 0.463158 | 0.746835 |
277 | 6C6 | 0.463158 | 0.883117 |
278 | NAJ PYZ | 0.46281 | 0.788235 |
279 | Y3J | 0.4625 | 0.706667 |
280 | B1U | 0.462264 | 0.72043 |
281 | LQJ | 0.462264 | 0.893333 |
282 | 7D7 | 0.461538 | 0.723684 |
283 | TXP | 0.46087 | 0.897436 |
284 | PO4 PO4 A A A A PO4 | 0.460784 | 0.878378 |
285 | S7M | 0.459184 | 0.694118 |
286 | 6IA | 0.458333 | 0.839506 |
287 | DDS | 0.458333 | 0.855263 |
288 | FAD | 0.458015 | 0.853659 |
289 | SFD | 0.458015 | 0.736842 |
290 | FAS | 0.458015 | 0.853659 |
291 | K3E | 0.457944 | 0.772152 |
292 | ODP | 0.456897 | 0.886076 |
293 | A3S | 0.456522 | 0.813333 |
294 | 7C5 | 0.453704 | 0.797468 |
295 | AAT | 0.453608 | 0.710843 |
296 | EEM | 0.453608 | 0.694118 |
297 | RGT | 0.45283 | 0.933333 |
298 | NPW | 0.452174 | 0.8875 |
299 | NDP | 0.452174 | 0.897436 |
300 | FAY | 0.451852 | 0.864198 |
301 | PGS | 0.451613 | 0.860759 |
302 | KOY | 0.45045 | 0.782051 |
303 | D5M | 0.449438 | 0.88 |
304 | DA | 0.449438 | 0.88 |
305 | NEC | 0.449438 | 0.727273 |
306 | 2SA | 0.44898 | 0.933333 |
307 | NIA | 0.448276 | 0.802469 |
308 | NZQ | 0.448276 | 0.910256 |
309 | A3T | 0.446809 | 0.8 |
310 | 128 | 0.446429 | 0.758621 |
311 | 6K6 | 0.445545 | 0.905405 |
312 | QXP | 0.445545 | 0.767442 |
313 | GEK | 0.445545 | 0.740741 |
314 | 4YB | 0.445455 | 0.764045 |
315 | 62F | 0.444444 | 0.864198 |
316 | FNK | 0.444444 | 0.806818 |
317 | V47 | 0.444444 | 0.763158 |
318 | AAM | 0.444444 | 0.944444 |
319 | Z5A | 0.443548 | 0.761364 |
320 | WSA | 0.442478 | 0.790698 |
321 | AMZ | 0.44186 | 0.891892 |
322 | C2R | 0.44186 | 0.88 |
323 | PLP AAD | 0.441667 | 0.717391 |
324 | 12D | 0.441441 | 0.767442 |
325 | XNP | 0.440678 | 0.851852 |
326 | RFL | 0.437956 | 0.823529 |
327 | 62X | 0.436893 | 0.670455 |
328 | N6P | 0.436893 | 0.890411 |
329 | NWQ | 0.436782 | 0.72 |
330 | AIR | 0.433735 | 0.876712 |
331 | N5O | 0.433333 | 0.766234 |
332 | GP3 | 0.43299 | 0.897436 |
333 | A6D | 0.432692 | 0.705882 |
334 | QXG | 0.432692 | 0.758621 |
335 | V1N | 0.431193 | 0.893333 |
336 | 649 | 0.429825 | 0.747253 |
337 | R2V | 0.428571 | 0.767442 |
338 | NA0 | 0.428571 | 0.907895 |
339 | GP2 | 0.428571 | 0.910256 |
340 | GDP | 0.428571 | 0.896104 |
341 | 0UM | 0.427184 | 0.702381 |
342 | KYB | 0.427184 | 0.73494 |
343 | DCA | 0.42623 | 0.825581 |
344 | ETB | 0.42623 | 0.835294 |
345 | 8Q2 | 0.426087 | 0.775281 |
346 | 9JJ | 0.425532 | 0.841463 |
347 | GNH | 0.424242 | 0.884615 |
348 | NAP | 0.424 | 0.92 |
349 | N5A | 0.423913 | 0.74026 |
350 | K2H | 0.423077 | 0.7375 |
351 | PUA | 0.422764 | 0.8625 |
352 | APU | 0.422414 | 0.871795 |
353 | 101 | 0.422222 | 0.855263 |
354 | K2W | 0.422018 | 0.743902 |
355 | 3AD | 0.421687 | 0.808219 |
356 | KY2 | 0.421569 | 0.73494 |
357 | FA9 | 0.42069 | 0.865854 |
358 | TAP | 0.420635 | 0.884615 |
359 | TM1 | 0.420561 | 0.755814 |
360 | P5F | 0.41958 | 0.825581 |
361 | 0T1 | 0.419355 | 0.825581 |
362 | COA | 0.419355 | 0.825581 |
363 | K15 | 0.419048 | 0.686047 |
364 | NYZ | 0.418367 | 0.910256 |
365 | 7RP | 0.417582 | 0.902778 |
366 | S8M | 0.417476 | 0.7625 |
367 | NHD | 0.416667 | 0.881579 |
368 | K38 | 0.416667 | 0.759494 |
369 | GTP | 0.415842 | 0.896104 |
370 | K2K | 0.415094 | 0.740741 |
371 | FAJ | 0.414966 | 0.833333 |
372 | FCX | 0.414062 | 0.797753 |
373 | KL2 | 0.413793 | 0.815789 |
374 | F2N | 0.413793 | 0.816092 |
375 | Q34 | 0.413793 | 0.678161 |
376 | 7RA | 0.413043 | 0.931507 |
377 | AS | 0.413043 | 0.835443 |
378 | G1R | 0.411765 | 0.884615 |
379 | K2R | 0.411215 | 0.881579 |
380 | SXZ | 0.411215 | 0.714286 |
381 | QQY | 0.411111 | 0.794872 |
382 | ACK | 0.411111 | 0.837838 |
383 | DZ4 | 0.41 | 0.883117 |
384 | 30N | 0.409449 | 0.755319 |
385 | 1DG | 0.409449 | 0.897436 |
386 | DG1 | 0.409449 | 0.897436 |
387 | J7V | 0.409449 | 0.813953 |
388 | AMX | 0.409449 | 0.835294 |
389 | CAO | 0.409449 | 0.797753 |
390 | COS | 0.409449 | 0.806818 |
391 | K3H | 0.409091 | 0.731707 |
392 | KYE | 0.409091 | 0.717647 |
393 | NAD BBN | 0.408759 | 0.821429 |
394 | 8BR | 0.408602 | 0.883117 |
395 | EO7 | 0.408602 | 0.770115 |
396 | 9BG | 0.408333 | 0.873418 |
397 | NVA 2AD | 0.408163 | 0.7625 |
398 | 9GM | 0.407767 | 0.873418 |
399 | D3Y | 0.407767 | 0.792208 |
400 | GSP | 0.407767 | 0.851852 |
401 | G2P | 0.407767 | 0.910256 |
402 | GNP | 0.407767 | 0.873418 |
403 | KY5 | 0.407407 | 0.728395 |
404 | CC5 | 0.407407 | 0.819444 |
405 | KB1 | 0.407407 | 0.702381 |
406 | N01 | 0.406504 | 0.881579 |
407 | SCO | 0.40625 | 0.825581 |
408 | CMX | 0.40625 | 0.825581 |
409 | HDV | 0.405941 | 0.87013 |
410 | Q2P | 0.404959 | 0.678161 |
411 | 2BA | 0.404255 | 0.890411 |
412 | CMP | 0.404255 | 0.876712 |
413 | ACO | 0.403101 | 0.797753 |
414 | FAM | 0.403101 | 0.806818 |
415 | NAD CJ3 | 0.402878 | 0.793103 |
416 | 2VA | 0.402062 | 0.779221 |
417 | KY8 | 0.401869 | 0.731707 |
418 | 3NZ | 0.401869 | 0.78481 |
419 | CZF | 0.4 | 0.906667 |
420 | HAX | 0.4 | 0.806818 |
421 | QQX | 0.4 | 0.78481 |
422 | OZP | 0.4 | 0.731707 |
423 | 26A | 0.4 | 0.74359 |
424 | NX8 | 0.4 | 0.719512 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | ADP ALF | 0.9672 |
2 | ALF GDP | 0.9574 |
3 | GDP ALF | 0.9543 |
4 | GDP BEF | 0.9527 |
5 | ADP AF3 | 0.9456 |
6 | GDP AF3 | 0.9455 |
7 | BEF GDP | 0.9450 |
8 | DBG | 0.9389 |
9 | UTP | 0.9261 |
10 | GDP MG | 0.9218 |
11 | MGT | 0.9160 |
12 | DGT | 0.9114 |
13 | MGP | 0.9094 |
14 | MGO | 0.9077 |
15 | TTP | 0.9066 |
16 | CTP | 0.9009 |
17 | Y9Z | 0.9008 |
18 | ADP VO4 | 0.8876 |
19 | DCP | 0.8847 |
20 | GAV | 0.8811 |
21 | UNP | 0.8752 |
22 | 2KH | 0.8740 |
23 | GH3 | 0.8712 |
24 | DGI | 0.8664 |
25 | MOD | 0.8652 |
26 | IDP | 0.8650 |
27 | DUT | 0.8592 |
28 | M7G | 0.8562 |
29 | DUP | 0.8558 |
This union binding pocket(no: 1) in the query (biounit: 3hxu.bio1) has 24 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 3G1Z | AMP | 2.76074 |
2 | 3G1Z | AMP | 2.76074 |