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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 | 3HJQ | Ki = 6.5 uM | MBD | C7 H8 O2 | Cc1cccc(c1.... |
2 | 3HKP | Ki = 310 uM | DHB | C7 H6 O4 | c1cc(c(cc1.... |
3 | 3I4V | Ki = 0.7 uM | 3CE | C6 H5 Cl O2 | c1cc(c(c(c.... |
4 | 3HHY | Ki = 3 uM | CAQ | C6 H6 O2 | c1ccc(c(c1.... |
5 | 3HJ8 | Ki = 1.5 uM | 4CL | C6 H5 Cl O2 | c1cc(c(cc1.... |
6 | 3HGI | - | BEZ | C7 H6 O2 | c1ccc(cc1).... |
7 | 3HJS | Ki = 4 uM | MCT | C7 H8 O2 | Cc1ccc(c(c.... |
8 | 3I4Y | Ki = 0.09 uM | 35C | C6 H4 Cl2 O2 | c1c(cc(c(c.... |
9 | 3HHX | Ki = 4.5 uM | PYG | C6 H6 O3 | c1cc(c(c(c.... |
10 | 3I51 | Ki = 0.02 uM | 45C | C6 H4 Cl2 O2 | c1c(c(cc(c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 3HJQ | Ki = 6.5 uM | MBD | C7 H8 O2 | Cc1cccc(c1.... |
2 | 3HKP | Ki = 310 uM | DHB | C7 H6 O4 | c1cc(c(cc1.... |
3 | 3I4V | Ki = 0.7 uM | 3CE | C6 H5 Cl O2 | c1cc(c(c(c.... |
4 | 3HHY | Ki = 3 uM | CAQ | C6 H6 O2 | c1ccc(c(c1.... |
5 | 3HJ8 | Ki = 1.5 uM | 4CL | C6 H5 Cl O2 | c1cc(c(cc1.... |
6 | 3HGI | - | BEZ | C7 H6 O2 | c1ccc(cc1).... |
7 | 3HJS | Ki = 4 uM | MCT | C7 H8 O2 | Cc1ccc(c(c.... |
8 | 3I4Y | Ki = 0.09 uM | 35C | C6 H4 Cl2 O2 | c1c(cc(c(c.... |
9 | 3HHX | Ki = 4.5 uM | PYG | C6 H6 O3 | c1cc(c(c(c.... |
10 | 3I51 | Ki = 0.02 uM | 45C | C6 H4 Cl2 O2 | c1c(c(cc(c.... |
11 | 2BOY | - | BHO | C7 H7 N O2 | c1ccc(cc1).... |
12 | 1S9A | - | BEZ | C7 H6 O2 | c1ccc(cc1).... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | PC7 | 1 | 1 |
2 | HGP | 1 | 1 |
3 | 6PL | 1 | 1 |
4 | LIO | 1 | 1 |
5 | HGX | 1 | 1 |
6 | PX4 | 1 | 1 |
7 | PLD | 1 | 1 |
8 | XP5 | 0.935484 | 1 |
9 | HXG | 0.873016 | 1 |
10 | PCW | 0.871429 | 0.981481 |
11 | PCK | 0.847222 | 0.946429 |
12 | 3PE | 0.80303 | 0.793103 |
13 | PEV | 0.80303 | 0.793103 |
14 | 8PE | 0.80303 | 0.793103 |
15 | PEF | 0.80303 | 0.793103 |
16 | PEH | 0.80303 | 0.793103 |
17 | PTY | 0.80303 | 0.793103 |
18 | PSC | 0.792208 | 0.981481 |
19 | 9PE | 0.791045 | 0.793103 |
20 | PEE | 0.764706 | 0.810345 |
21 | CD4 | 0.735294 | 0.727273 |
22 | PC1 | 0.732394 | 0.924528 |
23 | MC3 | 0.732394 | 0.924528 |
24 | PCF | 0.732394 | 0.924528 |
25 | PGT | 0.714286 | 0.701754 |
26 | LHG | 0.714286 | 0.701754 |
27 | 6OU | 0.706667 | 0.779661 |
28 | L9Q | 0.706667 | 0.779661 |
29 | LOP | 0.706667 | 0.779661 |
30 | RXY | 0.697368 | 0.779661 |
31 | P5S | 0.694444 | 0.745763 |
32 | K6G | 0.685714 | 0.963636 |
33 | LP3 | 0.685714 | 0.963636 |
34 | LPC | 0.685714 | 0.963636 |
35 | LAP | 0.685714 | 0.963636 |
36 | F57 | 0.681818 | 0.727273 |
37 | 7PH | 0.681818 | 0.727273 |
38 | 6PH | 0.681818 | 0.727273 |
39 | LPP | 0.681818 | 0.727273 |
40 | 3PH | 0.681818 | 0.727273 |
41 | 8SP | 0.680556 | 0.745763 |
42 | 7P9 | 0.671642 | 0.727273 |
43 | PX2 | 0.671642 | 0.773585 |
44 | PX8 | 0.671642 | 0.773585 |
45 | ZPE | 0.666667 | 0.779661 |
46 | CN3 | 0.657895 | 0.727273 |
47 | PA8 | 0.656716 | 0.773585 |
48 | LBN | 0.65 | 0.907407 |
49 | L9R | 0.65 | 0.907407 |
50 | POV | 0.65 | 0.907407 |
51 | GP7 | 0.638554 | 0.779661 |
52 | PEK | 0.634146 | 0.779661 |
53 | PGW | 0.632911 | 0.689655 |
54 | D3D | 0.632911 | 0.689655 |
55 | PII | 0.631579 | 0.655738 |
56 | CN6 | 0.631579 | 0.727273 |
57 | PD7 | 0.626866 | 0.727273 |
58 | DR9 | 0.625 | 0.689655 |
59 | PGV | 0.625 | 0.689655 |
60 | P6L | 0.617284 | 0.689655 |
61 | PGK | 0.617284 | 0.666667 |
62 | PIF | 0.615385 | 0.645161 |
63 | 44G | 0.611111 | 0.701754 |
64 | P50 | 0.609756 | 0.745763 |
65 | OZ2 | 0.609756 | 0.689655 |
66 | CDL | 0.608108 | 0.722222 |
67 | 42H | 0.607595 | 0.946429 |
68 | PIZ | 0.604938 | 0.655738 |
69 | M7U | 0.6 | 0.727273 |
70 | D21 | 0.6 | 0.714286 |
71 | DGG | 0.595238 | 0.666667 |
72 | PSF | 0.594595 | 0.745763 |
73 | 43Y | 0.594203 | 0.962264 |
74 | 52N | 0.592593 | 0.645161 |
75 | PIO | 0.592593 | 0.645161 |
76 | IP9 | 0.592593 | 0.655738 |
77 | PG8 | 0.578947 | 0.701754 |
78 | DLP | 0.574713 | 0.907407 |
79 | 44E | 0.573529 | 0.727273 |
80 | B7N | 0.564706 | 0.645161 |
81 | 8ND | 0.56338 | 0.614035 |
82 | PC5 | 0.56 | 0.824561 |
83 | PDK | 0.55914 | 0.777778 |
84 | AGA | 0.544304 | 0.701754 |
85 | EPH | 0.537634 | 0.779661 |
86 | LPX | 0.533333 | 0.775862 |
87 | 3PC | 0.531646 | 0.90566 |
88 | PIE | 0.522727 | 0.629032 |
89 | P3A | 0.505618 | 0.689655 |
90 | T7X | 0.505376 | 0.645161 |
91 | PQJ | 0.477612 | 0.886792 |
92 | OPC | 0.472527 | 0.963636 |
93 | LPE | 0.467532 | 0.909091 |
94 | NKO | 0.452055 | 0.696429 |
95 | NKN | 0.452055 | 0.696429 |
96 | CN5 | 0.451219 | 0.745455 |
97 | SPU | 0.445783 | 0.803279 |
98 | 3XU | 0.44086 | 0.809524 |
99 | OCB | 0.438356 | 0.796296 |
100 | S12 | 0.41573 | 0.716667 |
101 | I35 | 0.409639 | 0.606557 |
102 | NKP | 0.402439 | 0.684211 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 2CQ | 0.9986 |
2 | F4Z | 0.9975 |
3 | 150 | 0.9939 |
4 | 1WG | 0.9888 |
5 | 25W | 0.9768 |
6 | G6D | 0.9757 |
7 | 43M | 0.9683 |
8 | QWN | 0.9645 |
9 | TH0 | 0.9636 |
10 | MCT | 0.9627 |
11 | TLD | 0.9618 |
12 | 4JO | 0.9617 |
13 | MWM | 0.9617 |
14 | HT4 | 0.9596 |
15 | 7CZ | 0.9594 |
16 | 4ZE | 0.9585 |
17 | 5UC | 0.9582 |
18 | MZG | 0.9580 |
19 | 4HO | 0.9578 |
20 | 2YU | 0.9576 |
21 | 34A | 0.9575 |
22 | 275 | 0.9572 |
23 | 5MH | 0.9570 |
24 | URF | 0.9566 |
25 | PYD | 0.9564 |
26 | ICP | 0.9564 |
27 | XBZ | 0.9564 |
28 | TM7 | 0.9562 |
29 | TDR | 0.9557 |
30 | 2MP | 0.9557 |
31 | XXR | 0.9555 |
32 | JZ2 | 0.9554 |
33 | 2AC | 0.9552 |
34 | 4CL | 0.9551 |
35 | BGC | 0.9551 |
36 | 5JC | 0.9550 |
37 | QOS | 0.9547 |
38 | IUR | 0.9547 |
39 | F5B | 0.9545 |
40 | XYD | 0.9544 |
41 | 27Y | 0.9541 |
42 | BR9 | 0.9539 |
43 | 3ZQ | 0.9537 |
44 | MWJ | 0.9534 |
45 | QXW | 0.9532 |
46 | 0TR | 0.9529 |
47 | 1PT | 0.9522 |
48 | A1U | 0.9521 |
49 | 4JJ | 0.9515 |
50 | WBU | 0.9509 |
51 | 1MC | 0.9507 |
52 | GLC | 0.9505 |
53 | 6M9 | 0.9500 |
54 | EXO | 0.9495 |
55 | 8S0 | 0.9488 |
56 | SVN | 0.9485 |
57 | 0RW | 0.9478 |
58 | 3DO | 0.9476 |
59 | G3F | 0.9471 |
60 | DMD | 0.9470 |
61 | 5CL | 0.9468 |
62 | Y8I | 0.9468 |
63 | 1DW | 0.9467 |
64 | RAM | 0.9463 |
65 | 4ZC | 0.9454 |
66 | IDH | 0.9452 |
67 | IT2 | 0.9448 |
68 | 3Z7 | 0.9442 |
69 | OXE | 0.9432 |
70 | 8H8 | 0.9422 |
71 | BEZ | 0.9420 |
72 | ISN | 0.9420 |
73 | F05 | 0.9420 |
74 | HMH | 0.9417 |
75 | RSF | 0.9417 |
76 | NBZ | 0.9416 |
77 | BZX | 0.9413 |
78 | 7W4 | 0.9410 |
79 | KJY | 0.9409 |
80 | 9EW | 0.9409 |
81 | KKN | 0.9408 |
82 | 6M4 | 0.9408 |
83 | ADZ | 0.9407 |
84 | YAN | 0.9405 |
85 | 3ID | 0.9405 |
86 | GAL | 0.9402 |
87 | YCP | 0.9400 |
88 | 6AI | 0.9395 |
89 | FYU | 0.9395 |
90 | BEN | 0.9394 |
91 | GXY | 0.9391 |
92 | 1P7 | 0.9388 |
93 | TH7 | 0.9387 |
94 | NSP | 0.9384 |
95 | 7B4 | 0.9379 |
96 | ISE | 0.9378 |
97 | NK | 0.9376 |
98 | QUZ | 0.9373 |
99 | HLR | 0.9371 |
100 | 6PC | 0.9371 |
101 | AHR | 0.9367 |
102 | 40O | 0.9364 |
103 | BEW | 0.9362 |
104 | XYP | 0.9362 |
105 | M58 | 0.9361 |
106 | ES7 | 0.9358 |
107 | NPY | 0.9358 |
108 | GCS | 0.9357 |
109 | ES9 | 0.9353 |
110 | 5WV | 0.9351 |
111 | 2CH | 0.9348 |
112 | BAM | 0.9348 |
113 | DEN | 0.9347 |
114 | 24B | 0.9346 |
115 | H4N | 0.9346 |
116 | ZZT | 0.9344 |
117 | HTS | 0.9343 |
118 | CAQ | 0.9343 |
119 | 5MB | 0.9340 |
120 | 5B1 | 0.9338 |
121 | NCA | 0.9332 |
122 | INS | 0.9329 |
123 | 11S | 0.9329 |
124 | 4XR | 0.9327 |
125 | FK1 | 0.9324 |
126 | ALL | 0.9322 |
127 | JZ3 | 0.9320 |
128 | 5MI | 0.9318 |
129 | 0CT | 0.9318 |
130 | 0R0 | 0.9317 |
131 | PBC | 0.9317 |
132 | LXC | 0.9315 |
133 | SAL | 0.9312 |
134 | F60 | 0.9310 |
135 | IND | 0.9310 |
136 | SS1 | 0.9306 |
137 | 6X8 | 0.9304 |
138 | 1AN | 0.9303 |
139 | 2AF | 0.9301 |
140 | GYE | 0.9300 |
141 | BZI | 0.9299 |
142 | 4JP | 0.9297 |
143 | BTE | 0.9297 |
144 | 93Q | 0.9295 |
145 | L89 | 0.9294 |
146 | 5H1 | 0.9293 |
147 | FP2 | 0.9293 |
148 | BZF | 0.9293 |
149 | 32X | 0.9293 |
150 | 14O | 0.9292 |
151 | 938 | 0.9290 |
152 | JAE | 0.9287 |
153 | NIO | 0.9286 |
154 | 2K4 | 0.9285 |
155 | 76X | 0.9278 |
156 | 92Z | 0.9273 |
157 | 0R1 | 0.9271 |
158 | GVH | 0.9270 |
159 | 8LG | 0.9268 |
160 | MPI | 0.9266 |
161 | G3E | 0.9265 |
162 | 5Q0 | 0.9263 |
163 | ADE | 0.9263 |
164 | 3PF | 0.9262 |
165 | 24W | 0.9260 |
166 | HPA | 0.9259 |
167 | HMU | 0.9259 |
168 | FUL | 0.9259 |
169 | BHO | 0.9258 |
170 | 1NP | 0.9257 |
171 | PZA | 0.9256 |
172 | 6MP | 0.9256 |
173 | JBK | 0.9255 |
174 | UNU | 0.9255 |
175 | FPY | 0.9255 |
176 | IDM | 0.9254 |
177 | 3HA | 0.9251 |
178 | QSC | 0.9250 |
179 | 8GC | 0.9249 |
180 | ES4 | 0.9247 |
181 | HX3 | 0.9247 |
182 | 4XH | 0.9244 |
183 | BP1 | 0.9241 |
184 | 3U4 | 0.9238 |
185 | B53 | 0.9238 |
186 | HH8 | 0.9237 |
187 | 9DA | 0.9236 |
188 | HQY | 0.9235 |
189 | 7HP | 0.9235 |
190 | T6C | 0.9234 |
191 | 3M0 | 0.9232 |
192 | 7WA | 0.9232 |
193 | LZ1 | 0.9232 |
194 | NTN | 0.9230 |
195 | VGL | 0.9230 |
196 | DBH | 0.9229 |
197 | FE DB1 | 0.9227 |
198 | 10L | 0.9226 |
199 | 1LM | 0.9225 |
200 | ES1 | 0.9224 |
201 | 1SQ | 0.9224 |
202 | 1LQ | 0.9223 |
203 | RM1 | 0.9222 |
204 | 5IQ | 0.9221 |
205 | 8NY | 0.9220 |
206 | 2CK | 0.9220 |
207 | 5SG | 0.9219 |
208 | 3F0 | 0.9217 |
209 | WOO | 0.9217 |
210 | 286 | 0.9215 |
211 | JBE | 0.9214 |
212 | 9HX | 0.9213 |
213 | KOJ | 0.9210 |
214 | PM6 | 0.9210 |
215 | ABE | 0.9210 |
216 | I3A | 0.9209 |
217 | XQ0 | 0.9208 |
218 | AC0 | 0.9208 |
219 | GBD | 0.9207 |
220 | O72 | 0.9207 |
221 | LGC | 0.9207 |
222 | BE7 | 0.9206 |
223 | 4SV | 0.9205 |
224 | COU | 0.9205 |
225 | BE2 | 0.9204 |
226 | JPZ | 0.9204 |
227 | I1N | 0.9204 |
228 | FUC | 0.9202 |
229 | CRS | 0.9200 |
230 | JBH | 0.9200 |
231 | DHQ | 0.9199 |
232 | 4YS | 0.9197 |
233 | JFD | 0.9196 |
234 | NEQ | 0.9196 |
235 | JB5 | 0.9194 |
236 | 7HQ | 0.9194 |
237 | FCA | 0.9190 |
238 | ES6 | 0.9186 |
239 | XYS | 0.9185 |
240 | JZ0 | 0.9184 |
241 | 42A | 0.9184 |
242 | BBF | 0.9182 |
243 | N5J | 0.9179 |
244 | 0MK | 0.9178 |
245 | M1A | 0.9176 |
246 | 0P6 | 0.9176 |
247 | 9MG | 0.9175 |
248 | RIP | 0.9175 |
249 | NMJ | 0.9175 |
250 | TP5 | 0.9174 |
251 | 35C | 0.9174 |
252 | 4Z4 | 0.9173 |
253 | 1U6 | 0.9173 |
254 | J1Z | 0.9172 |
255 | OXQ | 0.9172 |
256 | BOA | 0.9172 |
257 | RCO | 0.9172 |
258 | 4CS | 0.9171 |
259 | JIF | 0.9170 |
260 | URA | 0.9170 |
261 | 1XN | 0.9169 |
262 | E7Z | 0.9169 |
263 | LZM | 0.9168 |
264 | DFU | 0.9168 |
265 | 0W8 | 0.9167 |
266 | Q88 | 0.9167 |
267 | 7MH | 0.9165 |
268 | JXN | 0.9164 |
269 | AZA | 0.9163 |
270 | BCF | 0.9162 |
271 | 5RG | 0.9161 |
272 | XAN | 0.9161 |
273 | 3XX | 0.9161 |
274 | IBF | 0.9161 |
275 | JZ9 | 0.9160 |
276 | SE2 | 0.9160 |
277 | LT2 | 0.9158 |
278 | FOA | 0.9157 |
279 | PCI | 0.9156 |
280 | 2AQ | 0.9156 |
281 | OCH | 0.9154 |
282 | 5QY | 0.9152 |
283 | SWD | 0.9151 |
284 | ES5 | 0.9150 |
285 | BCP | 0.9150 |
286 | 53C | 0.9150 |
287 | 1XM | 0.9149 |
288 | V55 | 0.9148 |
289 | GOO | 0.9148 |
290 | DQN | 0.9147 |
291 | AJV | 0.9147 |
292 | YH7 | 0.9146 |
293 | D48 | 0.9146 |
294 | QX2 | 0.9145 |
295 | BMA | 0.9143 |
296 | 03V | 0.9143 |
297 | 7VJ | 0.9142 |
298 | GTQ | 0.9142 |
299 | QWW | 0.9141 |
300 | GAG | 0.9140 |
301 | PYC | 0.9139 |
302 | J5I | 0.9138 |
303 | LG3 | 0.9137 |
304 | GUN | 0.9136 |
305 | CYT | 0.9136 |
306 | KBG | 0.9136 |
307 | HFB | 0.9135 |
308 | 9DG | 0.9135 |
309 | 3NT | 0.9130 |
310 | 4FS | 0.9130 |
311 | KUF | 0.9129 |
312 | 26D | 0.9129 |
313 | 1WD | 0.9127 |
314 | 1XX | 0.9127 |
315 | 4M4 | 0.9127 |
316 | BVF | 0.9126 |
317 | LG5 | 0.9124 |
318 | H42 | 0.9122 |
319 | PXM | 0.9122 |
320 | 6AP | 0.9121 |
321 | SHG | 0.9121 |
322 | HGQ | 0.9119 |
323 | CIG | 0.9119 |
324 | 2PC | 0.9118 |
325 | EQT | 0.9117 |
326 | 284 | 0.9117 |
327 | 290 | 0.9114 |
328 | HEW | 0.9114 |
329 | 2EC | 0.9114 |
330 | IGA | 0.9113 |
331 | F3B | 0.9109 |
332 | 2D0 | 0.9109 |
333 | CWS | 0.9109 |
334 | 3CH | 0.9106 |
335 | A2F | 0.9105 |
336 | JAB | 0.9104 |
337 | JKE | 0.9103 |
338 | 4NC | 0.9101 |
339 | OAA | 0.9101 |
340 | JZ1 | 0.9100 |
341 | 141 | 0.9100 |
342 | XBT | 0.9100 |
343 | 2HQ | 0.9099 |
344 | 86J | 0.9099 |
345 | 0CU | 0.9098 |
346 | B3R | 0.9098 |
347 | M3T | 0.9098 |
348 | XQG | 0.9092 |
349 | TZC | 0.9091 |
350 | 8GF | 0.9090 |
351 | AZG | 0.9088 |
352 | 6F0 | 0.9088 |
353 | GAB | 0.9088 |
354 | GRE | 0.9087 |
355 | 4H2 | 0.9087 |
356 | OVV | 0.9086 |
357 | 5HN | 0.9085 |
358 | CFP | 0.9083 |
359 | 23A | 0.9081 |
360 | HHQ | 0.9081 |
361 | 5M0 | 0.9080 |
362 | L3Q | 0.9077 |
363 | PRO | 0.9076 |
364 | HY3 | 0.9076 |
365 | 3HB | 0.9075 |
366 | CWM | 0.9074 |
367 | PCR | 0.9074 |
368 | 8CM | 0.9073 |
369 | 2ZV | 0.9072 |
370 | SOE | 0.9071 |
371 | 6CS | 0.9071 |
372 | F0J | 0.9071 |
373 | ABV | 0.9070 |
374 | 7WV | 0.9068 |
375 | 5XC | 0.9060 |
376 | 3AB | 0.9058 |
377 | 54G | 0.9057 |
378 | MEW | 0.9054 |
379 | 67N | 0.9054 |
380 | WCE | 0.9054 |
381 | DX4 | 0.9054 |
382 | BRT | 0.9052 |
383 | 25R | 0.9051 |
384 | PXL | 0.9051 |
385 | BZ3 | 0.9051 |
386 | PE0 | 0.9050 |
387 | UEG | 0.9049 |
388 | TBP | 0.9047 |
389 | 3BZ | 0.9044 |
390 | PYG | 0.9044 |
391 | LKA | 0.9044 |
392 | DUC | 0.9044 |
393 | PFB | 0.9043 |
394 | DGJ | 0.9043 |
395 | 60P | 0.9043 |
396 | 5WX | 0.9041 |
397 | 273 | 0.9038 |
398 | HH5 | 0.9037 |
399 | ES0 | 0.9037 |
400 | AZ8 | 0.9036 |
401 | FDB | 0.9032 |
402 | HHA | 0.9031 |
403 | ARB | 0.9030 |
404 | 6HQ | 0.9029 |
405 | SX1 | 0.9026 |
406 | Q24 | 0.9025 |
407 | MBD | 0.9025 |
408 | FA0 | 0.9024 |
409 | MR1 | 0.9020 |
410 | 4HC | 0.9020 |
411 | 285 | 0.9019 |
412 | 5MK | 0.9018 |
413 | 3CE | 0.9018 |
414 | M5K | 0.9015 |
415 | UNC | 0.9015 |
416 | SYN | 0.9013 |
417 | MUA | 0.9013 |
418 | 5OB | 0.9013 |
419 | YTB | 0.9011 |
420 | 82I | 0.9010 |
421 | NOJ | 0.9009 |
422 | AQO | 0.9004 |
423 | 3FA | 0.9004 |
424 | 9TZ | 0.9002 |
425 | PBR | 0.9002 |
426 | 6MH | 0.9001 |
427 | TMZ | 0.9001 |
428 | 3MH | 0.9000 |
429 | 265 | 0.9000 |
430 | 14J | 0.8998 |
431 | HQE | 0.8997 |
432 | AJ2 | 0.8997 |
433 | R8A | 0.8996 |
434 | 3MC | 0.8995 |
435 | ISZ | 0.8995 |
436 | 3Z8 | 0.8994 |
437 | RM4 | 0.8994 |
438 | 2C9 | 0.8993 |
439 | 4CH | 0.8990 |
440 | NIZ | 0.8990 |
441 | 4XX | 0.8990 |
442 | 3WA | 0.8989 |
443 | RNS | 0.8988 |
444 | XM0 | 0.8985 |
445 | KT7 | 0.8985 |
446 | B60 | 0.8982 |
447 | RIB | 0.8981 |
448 | BML | 0.8980 |
449 | FPN | 0.8980 |
450 | 4JN | 0.8980 |
451 | DRL | 0.8979 |
452 | 282 | 0.8979 |
453 | 7VS | 0.8977 |
454 | MWP | 0.8976 |
455 | EUG | 0.8974 |
456 | FLM | 0.8971 |
457 | 3RK | 0.8970 |
458 | 2MY | 0.8970 |
459 | M0Q | 0.8968 |
460 | GMN | 0.8966 |
461 | C2U | 0.8966 |
462 | 64K | 0.8965 |
463 | 4JT | 0.8962 |
464 | FFP | 0.8961 |
465 | 2A9 | 0.8960 |
466 | DA1 | 0.8960 |
467 | PXY | 0.8960 |
468 | LG4 | 0.8959 |
469 | P9P | 0.8959 |
470 | JBQ | 0.8957 |
471 | 2CM | 0.8956 |
472 | 270 | 0.8956 |
473 | MFB | 0.8955 |
474 | MNM | 0.8955 |
475 | NPO | 0.8953 |
476 | 6M1 | 0.8951 |
477 | FBB | 0.8951 |
478 | 2AK | 0.8951 |
479 | F81 | 0.8951 |
480 | PLQ | 0.8950 |
481 | IOL | 0.8950 |
482 | HPY | 0.8950 |
483 | M1Q | 0.8950 |
484 | AX7 | 0.8949 |
485 | 3IT | 0.8949 |
486 | 3SK | 0.8948 |
487 | FUF | 0.8947 |
488 | D07 | 0.8946 |
489 | DIU | 0.8945 |
490 | J9W | 0.8943 |
491 | 5NU | 0.8942 |
492 | C21 | 0.8942 |
493 | DUB | 0.8942 |
494 | HLZ | 0.8942 |
495 | ABN | 0.8941 |
496 | 4A3 | 0.8939 |
497 | 1P3 | 0.8939 |
498 | 0JD | 0.8939 |
499 | QBK | 0.8937 |
500 | ARA | 0.8935 |
501 | 2HO | 0.8935 |
502 | HQD | 0.8934 |
503 | 4AA | 0.8933 |
504 | 93K | 0.8931 |
505 | MAQ | 0.8931 |
506 | IFL | 0.8930 |
507 | M6N | 0.8930 |
508 | DHB | 0.8929 |
509 | ZBT | 0.8928 |
510 | FCB | 0.8926 |
511 | HIS | 0.8925 |
512 | MYJ | 0.8923 |
513 | 3HM | 0.8923 |
514 | JBN | 0.8923 |
515 | OXC | 0.8922 |
516 | 4HM | 0.8921 |
517 | R8V | 0.8921 |
518 | ASO | 0.8920 |
519 | VNJ | 0.8920 |
520 | K2T | 0.8919 |
521 | SYV | 0.8918 |
522 | INO | 0.8918 |
523 | SMV | 0.8917 |
524 | G4D | 0.8917 |
525 | G2F | 0.8917 |
526 | ADK | 0.8917 |
527 | P92 | 0.8915 |
528 | KIV | 0.8914 |
529 | 2MI | 0.8913 |
530 | FQI | 0.8912 |
531 | DBJ | 0.8911 |
532 | 9TW | 0.8910 |
533 | DOB | 0.8910 |
534 | BHA | 0.8910 |
535 | CFI | 0.8910 |
536 | M1H | 0.8910 |
537 | AZ9 | 0.8906 |
538 | 95Z | 0.8904 |
539 | MSN | 0.8902 |
540 | YIO | 0.8901 |
541 | 2MH | 0.8900 |
542 | 4M0 | 0.8899 |
543 | 36R | 0.8899 |
544 | R8S | 0.8898 |
545 | A7W | 0.8898 |
546 | 6GU | 0.8895 |
547 | MRW | 0.8895 |
548 | XX2 | 0.8894 |
549 | FOT | 0.8893 |
550 | TMT | 0.8893 |
551 | TM4 | 0.8891 |
552 | IJZ | 0.8891 |
553 | CHB | 0.8891 |
554 | XYL | 0.8890 |
555 | 261 | 0.8890 |
556 | DFB | 0.8890 |
557 | MAN | 0.8889 |
558 | 12M | 0.8887 |
559 | ORO | 0.8886 |
560 | FHB | 0.8885 |
561 | 3MA | 0.8885 |
562 | B62 | 0.8884 |
563 | 5VM | 0.8882 |
564 | H3M | 0.8882 |
565 | GLA | 0.8881 |
566 | 12Q | 0.8881 |
567 | J9T | 0.8881 |
568 | 260 | 0.8880 |
569 | 39A | 0.8880 |
570 | NOY | 0.8880 |
571 | NNO | 0.8878 |
572 | MO8 | 0.8876 |
573 | VGD | 0.8875 |
574 | NDM | 0.8875 |
575 | DIN | 0.8874 |
576 | BSX | 0.8871 |
577 | FP1 | 0.8870 |
578 | QSB | 0.8870 |
579 | FPK | 0.8870 |
580 | JXW | 0.8869 |
581 | IPB | 0.8869 |
582 | PHB | 0.8866 |
583 | 6RQ | 0.8865 |
584 | FAN | 0.8864 |
585 | 1P8 | 0.8864 |
586 | M0W | 0.8863 |
587 | 4JQ | 0.8863 |
588 | MLT | 0.8863 |
589 | ZWZ | 0.8863 |
590 | AW5 | 0.8863 |
591 | 7W1 | 0.8861 |
592 | F31 | 0.8860 |
593 | HJP | 0.8860 |
594 | TBS | 0.8860 |
595 | HBA | 0.8860 |
596 | G5V | 0.8859 |
597 | URC | 0.8859 |
598 | KYD | 0.8858 |
599 | IHB | 0.8857 |
600 | JUG | 0.8856 |
601 | KJH | 0.8856 |
602 | CLW | 0.8856 |
603 | F9Y | 0.8855 |
604 | MAK | 0.8854 |
605 | EA1 | 0.8853 |
606 | YHO | 0.8853 |
607 | PY7 | 0.8850 |
608 | SKA | 0.8846 |
609 | 23W | 0.8845 |
610 | 149 | 0.8841 |
611 | H8N | 0.8840 |
612 | 3OC | 0.8838 |
613 | 2ZX | 0.8838 |
614 | HXX | 0.8838 |
615 | 0FO | 0.8836 |
616 | ET2 | 0.8836 |
617 | TEP | 0.8835 |
618 | KG7 | 0.8835 |
619 | JLZ | 0.8833 |
620 | CTS | 0.8833 |
621 | 5QX | 0.8833 |
622 | KJU | 0.8830 |
623 | 2DR | 0.8829 |
624 | LDP | 0.8827 |
625 | 8ZE | 0.8827 |
626 | HQT | 0.8826 |
627 | GZL | 0.8823 |
628 | MQN | 0.8822 |
629 | BTY | 0.8822 |
630 | XHP | 0.8821 |
631 | 5RN | 0.8821 |
632 | HBX | 0.8820 |
633 | 4VP | 0.8820 |
634 | 2LP | 0.8820 |
635 | IFM | 0.8819 |
636 | IV2 | 0.8818 |
637 | G1O | 0.8818 |
638 | 4YO | 0.8818 |
639 | K17 | 0.8818 |
640 | VNL | 0.8816 |
641 | 75K | 0.8815 |
642 | 8OZ | 0.8814 |
643 | BR8 | 0.8813 |
644 | FBV | 0.8812 |
645 | 94N | 0.8812 |
646 | TTL | 0.8811 |
647 | 5CU | 0.8810 |
648 | 8WT | 0.8808 |
649 | 6UA | 0.8807 |
650 | MZB | 0.8806 |
651 | DIE | 0.8806 |
652 | 0TU | 0.8806 |
653 | HBD | 0.8805 |
654 | 2FG | 0.8805 |
655 | 6LW | 0.8805 |
656 | XAZ | 0.8804 |
657 | B55 | 0.8803 |
658 | Z82 | 0.8803 |
659 | 5JQ | 0.8803 |
660 | B57 | 0.8802 |
661 | TFU | 0.8802 |
662 | FBM | 0.8800 |
663 | 13X | 0.8800 |
664 | IF7 | 0.8800 |
665 | DTL | 0.8798 |
666 | WDL | 0.8797 |
667 | 2BG | 0.8796 |
668 | FSW | 0.8794 |
669 | 3AY | 0.8793 |
670 | 173 | 0.8790 |
671 | X05 | 0.8790 |
672 | 4HS | 0.8790 |
673 | ES2 | 0.8790 |
674 | ASC | 0.8790 |
675 | 7MU | 0.8788 |
676 | PBZ | 0.8788 |
677 | EVA | 0.8788 |
678 | 2XX | 0.8787 |
679 | CYS | 0.8786 |
680 | AX2 | 0.8786 |
681 | 5ZE | 0.8785 |
682 | M1E | 0.8784 |
683 | H76 | 0.8784 |
684 | DBX | 0.8782 |
685 | 0N7 | 0.8781 |
686 | 8IG | 0.8781 |
687 | 826 | 0.8779 |
688 | GOX | 0.8779 |
689 | PYQ | 0.8776 |
690 | ECE | 0.8776 |
691 | IP0 | 0.8776 |
692 | FRU | 0.8776 |
693 | P3K | 0.8775 |
694 | PYF | 0.8771 |
695 | 3DM | 0.8770 |
696 | 42C | 0.8770 |
697 | GCB | 0.8770 |
698 | LMR | 0.8767 |
699 | 1Y6 | 0.8765 |
700 | OXZ | 0.8764 |
701 | AZF | 0.8764 |
702 | SWA | 0.8763 |
703 | K5W | 0.8761 |
704 | AC6 | 0.8760 |
705 | PAB | 0.8760 |
706 | X09 | 0.8760 |
707 | K8X | 0.8760 |
708 | C2A | 0.8759 |
709 | CTL | 0.8757 |
710 | 44W | 0.8756 |
711 | ICO | 0.8756 |
712 | CFF | 0.8756 |
713 | OTW | 0.8755 |
714 | 5JL | 0.8754 |
715 | 4MA | 0.8753 |
716 | 1DU | 0.8753 |
717 | BDP | 0.8750 |
718 | 1MR | 0.8750 |
719 | URP | 0.8747 |
720 | 174 | 0.8746 |
721 | DQU | 0.8746 |
722 | QX4 | 0.8744 |
723 | HZQ | 0.8744 |
724 | MXN | 0.8743 |
725 | MT0 | 0.8743 |
726 | 8TX | 0.8742 |
727 | PRY | 0.8740 |
728 | 4JM | 0.8740 |
729 | PRF | 0.8738 |
730 | JND | 0.8737 |
731 | 2KT | 0.8737 |
732 | DOR | 0.8736 |
733 | JA8 | 0.8735 |
734 | GIO | 0.8734 |
735 | 12B | 0.8733 |
736 | GLT | 0.8733 |
737 | PHH | 0.8730 |
738 | 5GU | 0.8729 |
739 | PCA | 0.8728 |
740 | ERH | 0.8726 |
741 | PKU | 0.8726 |
742 | EYK | 0.8723 |
743 | 280 | 0.8723 |
744 | 5RO | 0.8722 |
745 | DMJ | 0.8722 |
746 | Q6T | 0.8722 |
747 | N2I | 0.8722 |
748 | SHA | 0.8721 |
749 | 2H5 | 0.8720 |
750 | LCN | 0.8720 |
751 | R2B | 0.8720 |
752 | F9P | 0.8719 |
753 | FPI | 0.8712 |
754 | 44V | 0.8711 |
755 | TFB | 0.8711 |
756 | 51R | 0.8710 |
757 | LRH | 0.8710 |
758 | GIF | 0.8708 |
759 | 8WO | 0.8708 |
760 | XUL | 0.8707 |
761 | LSA | 0.8706 |
762 | MRZ | 0.8706 |
763 | JYB | 0.8704 |
764 | PQ0 | 0.8704 |
765 | MVN | 0.8700 |
766 | EKZ | 0.8700 |
767 | GAF | 0.8700 |
768 | MB3 | 0.8698 |
769 | 495 | 0.8697 |
770 | 6ME | 0.8696 |
771 | YSO | 0.8693 |
772 | UAN | 0.8692 |
773 | 1KP | 0.8691 |
774 | PA1 | 0.8690 |
775 | 717 | 0.8690 |
776 | N8Y | 0.8688 |
777 | 15E | 0.8688 |
778 | NDH | 0.8688 |
779 | 069 | 0.8686 |
780 | 4MU | 0.8686 |
781 | 680 | 0.8685 |
782 | SXS | 0.8685 |
783 | HIU | 0.8685 |
784 | PAF | 0.8683 |
785 | LNR | 0.8682 |
786 | ICC | 0.8682 |
787 | AGK | 0.8682 |
788 | 7NI | 0.8681 |
789 | SOR | 0.8680 |
790 | 4P5 | 0.8680 |
791 | SRT | 0.8677 |
792 | DTI | 0.8675 |
793 | 6KX | 0.8675 |
794 | GXL | 0.8674 |
795 | OK7 | 0.8674 |
796 | TSS | 0.8672 |
797 | 3SL | 0.8672 |
798 | DYA | 0.8671 |
799 | 1DV | 0.8670 |
800 | 3MB | 0.8669 |
801 | TCZ | 0.8668 |
802 | ZVO | 0.8668 |
803 | GCU | 0.8668 |
804 | MLI | 0.8668 |
805 | VOH | 0.8667 |
806 | JZ4 | 0.8665 |
807 | TGX | 0.8660 |
808 | CGB | 0.8660 |
809 | GXE | 0.8660 |
810 | IPH | 0.8660 |
811 | FBW | 0.8659 |
812 | PZI | 0.8658 |
813 | FB2 | 0.8657 |
814 | ASN | 0.8655 |
815 | 948 | 0.8655 |
816 | MFU | 0.8655 |
817 | MBN | 0.8654 |
818 | 3FH | 0.8652 |
819 | 47J | 0.8651 |
820 | 7B3 | 0.8646 |
821 | 4PW | 0.8644 |
822 | MBG | 0.8643 |
823 | X6X | 0.8643 |
824 | 4JL | 0.8640 |
825 | C2B | 0.8640 |
826 | 5AN | 0.8640 |
827 | KP6 | 0.8635 |
828 | A65 | 0.8634 |
829 | 6VD | 0.8632 |
830 | XCZ | 0.8631 |
831 | 8CL | 0.8630 |
832 | MMZ | 0.8630 |
833 | SFU | 0.8630 |
834 | S76 | 0.8630 |
835 | NTM | 0.8629 |
836 | OVM | 0.8629 |
837 | RMN | 0.8628 |
838 | PHT | 0.8628 |
839 | TOF | 0.8628 |
840 | HVK | 0.8626 |
841 | E60 | 0.8623 |
842 | INE | 0.8623 |
843 | C5J | 0.8623 |
844 | 5WY | 0.8621 |
845 | AKH | 0.8620 |
846 | Z6J | 0.8617 |
847 | 3R6 | 0.8617 |
848 | HIO | 0.8615 |
849 | 3AP | 0.8615 |
850 | 2A7 | 0.8614 |
851 | FBT | 0.8613 |
852 | 9PO | 0.8613 |
853 | P72 | 0.8611 |
854 | GIV | 0.8611 |
855 | KDV | 0.8609 |
856 | KIB | 0.8607 |
857 | OW4 | 0.8607 |
858 | OVP | 0.8607 |
859 | 2ZQ | 0.8607 |
860 | KLW | 0.8606 |
861 | OHG | 0.8606 |
862 | 2AP | 0.8600 |
863 | 9KT | 0.8600 |
864 | A2Q | 0.8599 |
865 | FDK | 0.8595 |
866 | RHU | 0.8594 |
867 | URQ | 0.8592 |
868 | 9FL | 0.8592 |
869 | MS9 | 0.8591 |
870 | 92K | 0.8589 |
871 | 1LN | 0.8587 |
872 | CYH | 0.8587 |
873 | O7U | 0.8585 |
874 | DHK | 0.8583 |
875 | 24T | 0.8583 |
876 | RB5 | 0.8581 |
877 | HRZ | 0.8580 |
878 | 7ZE | 0.8576 |
879 | 1AB | 0.8574 |
880 | NID | 0.8572 |
881 | GM7 | 0.8572 |
882 | SVD | 0.8571 |
883 | LGA | 0.8570 |
884 | KPL | 0.8570 |
885 | 4AP | 0.8569 |
886 | 37T | 0.8569 |
887 | IFP | 0.8568 |
888 | UQ | 0.8568 |
889 | 1GN | 0.8566 |
890 | M2H | 0.8565 |
891 | ZZ3 | 0.8561 |
892 | GJS | 0.8561 |
893 | RPQ | 0.8561 |
894 | APY | 0.8560 |
895 | HAI | 0.8560 |
896 | VK3 | 0.8559 |
897 | A13 | 0.8558 |
898 | APZ | 0.8556 |
899 | UY7 | 0.8554 |
900 | WOT | 0.8553 |
901 | 329 | 0.8553 |
902 | TLA | 0.8552 |
903 | 3PY | 0.8551 |
904 | ABA | 0.8550 |
905 | K6X | 0.8546 |
906 | NQ | 0.8542 |
907 | PYJ | 0.8540 |
908 | BEA | 0.8540 |
909 | GCW | 0.8540 |
910 | DMI | 0.8539 |
911 | FH2 | 0.8536 |
912 | FUB | 0.8534 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 3i51.bio1) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3i51.bio1) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 3i51.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 3i51.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |