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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 6 families. | |||||
1 | 1I7B | - | PUT | C4 H12 N2 | C(CCN)CN |
2 | 3H0V | ic50 = 15 uM | M2T | C12 H19 N5 O3 S | CS(C)C[C@@.... |
3 | 3EPB | Ka = 10000 M^-1 | PUT | C4 H12 N2 | C(CCN)CN |
4 | 1I72 | - | PUT | C4 H12 N2 | C(CCN)CN |
5 | 3DZ4 | ic50 = 400 nM | C8M | C15 H23 N7 O4 | Cc1nc2c(nc.... |
6 | 3DZ5 | - | PUT | C4 H12 N2 | C(CCN)CN |
7 | 1I7C | ic50 = 0.4 uM | MGB | C5 H12 N8 | [H]/N=C(N).... |
8 | 3H0W | ic50 = 600 nM | N8M | C13 H20 N6 O3 | Cc1nc2c(nc.... |
9 | 3DZ6 | ic50 = 15 nM | M8E | C17 H27 N7 O4 | C[N@@](CCC.... |
10 | 3DZ7 | - | PUT | C4 H12 N2 | C(CCN)CN |
11 | 1I79 | - | PUT | C4 H12 N2 | C(CCN)CN |
12 | 3EPA | Ka = 2000 M^-1 | PUT | C4 H12 N2 | C(CCN)CN |
13 | 3DZ2 | ic50 = 70 uM | A8M | C15 H25 N7 O3 | Cc1nc2c(nc.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 6 families. | |||||
1 | 1I7B | - | PUT | C4 H12 N2 | C(CCN)CN |
2 | 3H0V | ic50 = 15 uM | M2T | C12 H19 N5 O3 S | CS(C)C[C@@.... |
3 | 3EPB | Ka = 10000 M^-1 | PUT | C4 H12 N2 | C(CCN)CN |
4 | 1I72 | - | PUT | C4 H12 N2 | C(CCN)CN |
5 | 3DZ4 | ic50 = 400 nM | C8M | C15 H23 N7 O4 | Cc1nc2c(nc.... |
6 | 3DZ5 | - | PUT | C4 H12 N2 | C(CCN)CN |
7 | 1I7C | ic50 = 0.4 uM | MGB | C5 H12 N8 | [H]/N=C(N).... |
8 | 3H0W | ic50 = 600 nM | N8M | C13 H20 N6 O3 | Cc1nc2c(nc.... |
9 | 3DZ6 | ic50 = 15 nM | M8E | C17 H27 N7 O4 | C[N@@](CCC.... |
10 | 3DZ7 | - | PUT | C4 H12 N2 | C(CCN)CN |
11 | 1I79 | - | PUT | C4 H12 N2 | C(CCN)CN |
12 | 3EPA | Ka = 2000 M^-1 | PUT | C4 H12 N2 | C(CCN)CN |
13 | 3DZ2 | ic50 = 70 uM | A8M | C15 H25 N7 O3 | Cc1nc2c(nc.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | M2T | 1 | 1 |
2 | ADN | 0.741379 | 0.828571 |
3 | RAB | 0.741379 | 0.828571 |
4 | XYA | 0.741379 | 0.828571 |
5 | S4M | 0.720588 | 0.844156 |
6 | 5N5 | 0.716667 | 0.828571 |
7 | 5CD | 0.704918 | 0.84058 |
8 | A4D | 0.704918 | 0.855072 |
9 | EP4 | 0.698413 | 0.941176 |
10 | MTA | 0.676923 | 0.940298 |
11 | DTA | 0.661538 | 0.819444 |
12 | 3DH | 0.656716 | 0.884058 |
13 | SAM | 0.636364 | 0.878378 |
14 | 5AD | 0.622951 | 0.80597 |
15 | MAO | 0.616438 | 0.765432 |
16 | ZAS | 0.614286 | 0.797297 |
17 | AMP | 0.614286 | 0.753247 |
18 | LMS | 0.614286 | 0.705882 |
19 | A | 0.614286 | 0.753247 |
20 | SMM | 0.6125 | 0.868421 |
21 | S7M | 0.6125 | 0.828947 |
22 | ABM | 0.611111 | 0.779221 |
23 | 45A | 0.611111 | 0.779221 |
24 | 6RE | 0.605634 | 0.766234 |
25 | SRA | 0.605634 | 0.7375 |
26 | AMP MG | 0.605634 | 0.786667 |
27 | AOC | 0.597222 | 0.830986 |
28 | DSH | 0.597222 | 0.8 |
29 | AP2 | 0.594595 | 0.707317 |
30 | A12 | 0.594595 | 0.707317 |
31 | A2D | 0.589041 | 0.734177 |
32 | A3N | 0.589041 | 0.819444 |
33 | J7C | 0.589041 | 0.753247 |
34 | 5AS | 0.586667 | 0.685393 |
35 | GJV | 0.581081 | 0.75641 |
36 | NWW | 0.575758 | 0.768116 |
37 | BA3 | 0.573333 | 0.734177 |
38 | GEK | 0.571429 | 0.837838 |
39 | MHZ | 0.571429 | 0.765432 |
40 | M33 | 0.571429 | 0.769231 |
41 | APC MG | 0.56962 | 0.75641 |
42 | B4P | 0.565789 | 0.734177 |
43 | ADP | 0.565789 | 0.734177 |
44 | AP5 | 0.565789 | 0.734177 |
45 | ACP | 0.564103 | 0.716049 |
46 | 5X8 | 0.564103 | 0.84507 |
47 | 7D7 | 0.5625 | 0.75 |
48 | Y3J | 0.560606 | 0.757143 |
49 | AN2 | 0.558442 | 0.725 |
50 | AT4 | 0.558442 | 0.728395 |
51 | ADP BEF | 0.558442 | 0.776316 |
52 | SON | 0.558442 | 0.707317 |
53 | A7D | 0.558442 | 0.833333 |
54 | ADP MG | 0.558442 | 0.776316 |
55 | APC | 0.556962 | 0.707317 |
56 | PRX | 0.556962 | 0.759494 |
57 | AU1 | 0.551282 | 0.716049 |
58 | ADX | 0.551282 | 0.705882 |
59 | CA0 | 0.551282 | 0.716049 |
60 | RBY | 0.55 | 0.707317 |
61 | ADV | 0.55 | 0.707317 |
62 | SA8 | 0.55 | 0.826667 |
63 | EEM | 0.548781 | 0.828947 |
64 | H1Q | 0.544304 | 0.766234 |
65 | HEJ | 0.544304 | 0.734177 |
66 | ATP | 0.544304 | 0.734177 |
67 | 50T | 0.544304 | 0.725 |
68 | SFG | 0.544304 | 0.780822 |
69 | KG4 | 0.544304 | 0.716049 |
70 | APR | 0.5375 | 0.734177 |
71 | AR6 | 0.5375 | 0.734177 |
72 | 5FA | 0.5375 | 0.734177 |
73 | AQP | 0.5375 | 0.734177 |
74 | ACQ | 0.536585 | 0.716049 |
75 | 3AM | 0.534247 | 0.717949 |
76 | A3G | 0.533333 | 0.783784 |
77 | NEC | 0.533333 | 0.777778 |
78 | AGS | 0.530864 | 0.719512 |
79 | ADP PO3 | 0.530864 | 0.776316 |
80 | ATP MG | 0.530864 | 0.776316 |
81 | AD9 | 0.530864 | 0.716049 |
82 | A5D | 0.530864 | 0.819444 |
83 | 5AL | 0.53012 | 0.746835 |
84 | 8LE | 0.53012 | 0.7625 |
85 | 3AD | 0.529412 | 0.814286 |
86 | SAH | 0.52439 | 0.821918 |
87 | BEF ADP | 0.52439 | 0.75641 |
88 | G5A | 0.52439 | 0.666667 |
89 | SAI | 0.52439 | 0.786667 |
90 | A5A | 0.52381 | 0.709302 |
91 | NWQ | 0.520548 | 0.797101 |
92 | TAT | 0.518072 | 0.728395 |
93 | T99 | 0.518072 | 0.728395 |
94 | ANP | 0.518072 | 0.716049 |
95 | GAP | 0.518072 | 0.7375 |
96 | 8LH | 0.517647 | 0.75 |
97 | 6YZ | 0.517647 | 0.716049 |
98 | KL2 | 0.513889 | 0.683544 |
99 | V2G | 0.511905 | 0.682353 |
100 | AAT | 0.511905 | 0.75641 |
101 | 54H | 0.511628 | 0.732558 |
102 | VMS | 0.511628 | 0.732558 |
103 | 52H | 0.511628 | 0.724138 |
104 | ATF | 0.505882 | 0.707317 |
105 | ANP MG | 0.505882 | 0.746835 |
106 | VO4 ADP | 0.505882 | 0.7375 |
107 | ALF ADP | 0.505882 | 0.719512 |
108 | TSB | 0.505747 | 0.701149 |
109 | 8LQ | 0.505747 | 0.75 |
110 | 53H | 0.505747 | 0.724138 |
111 | DAL AMP | 0.505747 | 0.769231 |
112 | QA7 | 0.505747 | 0.78481 |
113 | V47 | 0.5 | 0.791667 |
114 | 9ZD | 0.5 | 0.753086 |
115 | SSA | 0.5 | 0.666667 |
116 | 5SV | 0.5 | 0.722892 |
117 | 8QN | 0.5 | 0.746835 |
118 | SRP | 0.5 | 0.707317 |
119 | 9ZA | 0.5 | 0.753086 |
120 | 2AM | 0.5 | 0.708861 |
121 | A3S | 0.5 | 0.794521 |
122 | 0UM | 0.494382 | 0.769231 |
123 | PAJ | 0.494382 | 0.756098 |
124 | 4AD | 0.494382 | 0.719512 |
125 | LSS | 0.494382 | 0.727273 |
126 | HQG | 0.494253 | 0.725 |
127 | A3P | 0.493671 | 0.730769 |
128 | N5O | 0.493506 | 0.746667 |
129 | QQX | 0.493333 | 0.679012 |
130 | CC5 | 0.492537 | 0.826087 |
131 | K2H | 0.488889 | 0.861111 |
132 | NVA LMS | 0.488889 | 0.7 |
133 | 62X | 0.488889 | 0.820513 |
134 | 8X1 | 0.488636 | 0.645161 |
135 | KY2 | 0.488636 | 0.7375 |
136 | 5CA | 0.488636 | 0.666667 |
137 | A22 | 0.488636 | 0.725 |
138 | MAP | 0.488636 | 0.698795 |
139 | A3T | 0.487805 | 0.830986 |
140 | ACK | 0.486842 | 0.701299 |
141 | QQY | 0.486842 | 0.6875 |
142 | 7D5 | 0.486486 | 0.679012 |
143 | K15 | 0.483516 | 0.772152 |
144 | LEU LMS | 0.483516 | 0.755814 |
145 | OAD | 0.483516 | 0.7375 |
146 | 9X8 | 0.483516 | 0.740741 |
147 | 25A | 0.483146 | 0.734177 |
148 | OZV | 0.483146 | 0.734177 |
149 | OOB | 0.483146 | 0.725 |
150 | S8M | 0.483146 | 0.789474 |
151 | QXP | 0.483146 | 0.689655 |
152 | N5A | 0.481013 | 0.743243 |
153 | OVE | 0.480519 | 0.703704 |
154 | EU9 | 0.48 | 0.729412 |
155 | 26A | 0.478873 | 0.871429 |
156 | PR8 | 0.478261 | 0.666667 |
157 | K2K | 0.478261 | 0.766234 |
158 | A3R | 0.477778 | 0.690476 |
159 | DSZ | 0.477778 | 0.666667 |
160 | ADQ | 0.477778 | 0.716049 |
161 | NSS | 0.477778 | 0.685393 |
162 | AMO | 0.477778 | 0.707317 |
163 | A1R | 0.477778 | 0.690476 |
164 | KYB | 0.477778 | 0.7375 |
165 | 2BA | 0.475 | 0.727273 |
166 | CMP | 0.475 | 0.736842 |
167 | B5M | 0.473684 | 0.719512 |
168 | 9K8 | 0.473118 | 0.663043 |
169 | SXZ | 0.473118 | 0.853333 |
170 | TXA | 0.473118 | 0.728395 |
171 | 1ZZ | 0.473118 | 0.697674 |
172 | ME8 | 0.473118 | 0.759036 |
173 | NB8 | 0.473118 | 0.682353 |
174 | PTJ | 0.473118 | 0.765432 |
175 | 3OD | 0.473118 | 0.7375 |
176 | JNT | 0.472527 | 0.716049 |
177 | DLL | 0.472527 | 0.725 |
178 | AHX | 0.472527 | 0.682353 |
179 | 00A | 0.472527 | 0.690476 |
180 | K3H | 0.46875 | 0.826667 |
181 | MYR AMP | 0.468085 | 0.717647 |
182 | RP1 | 0.467532 | 0.7125 |
183 | SP1 | 0.467532 | 0.7125 |
184 | 3UK | 0.467391 | 0.716049 |
185 | ADP BMA | 0.467391 | 0.7375 |
186 | QXG | 0.467391 | 0.681818 |
187 | A6D | 0.467391 | 0.75 |
188 | 3D1 | 0.464789 | 0.756757 |
189 | MTP | 0.464789 | 0.783784 |
190 | 3L1 | 0.464789 | 0.756757 |
191 | K38 | 0.463158 | 0.786667 |
192 | WAQ | 0.462366 | 0.690476 |
193 | R2V | 0.462366 | 0.689655 |
194 | GSU | 0.462366 | 0.666667 |
195 | KY8 | 0.462366 | 0.75641 |
196 | B5V | 0.462366 | 0.707317 |
197 | KAA | 0.462366 | 0.645161 |
198 | LAD | 0.462366 | 0.674419 |
199 | P5A | 0.462366 | 0.638298 |
200 | PAP | 0.458824 | 0.721519 |
201 | 2FA | 0.458333 | 0.773333 |
202 | KMQ | 0.458333 | 0.728395 |
203 | 6MD | 0.458333 | 0.842857 |
204 | B5Y | 0.458333 | 0.719512 |
205 | K3K | 0.458333 | 0.786667 |
206 | BIS | 0.457447 | 0.690476 |
207 | FYA | 0.457447 | 0.725 |
208 | JB6 | 0.457447 | 0.710843 |
209 | A2P | 0.45679 | 0.717949 |
210 | 7MC | 0.456311 | 0.662921 |
211 | D3Y | 0.455556 | 0.773333 |
212 | GA7 | 0.454545 | 0.75 |
213 | YSA | 0.453608 | 0.666667 |
214 | K2W | 0.453608 | 0.746835 |
215 | KB1 | 0.452632 | 0.746835 |
216 | KY5 | 0.452632 | 0.776316 |
217 | 25L | 0.452632 | 0.725 |
218 | 2VA | 0.452381 | 0.859155 |
219 | 5F1 | 0.452055 | 0.739726 |
220 | K3E | 0.44898 | 0.776316 |
221 | 9SN | 0.447917 | 0.682353 |
222 | 7D3 | 0.444444 | 0.662651 |
223 | FA5 | 0.443299 | 0.707317 |
224 | ATP A | 0.443299 | 0.766234 |
225 | ATP A A A | 0.443299 | 0.766234 |
226 | 8PZ | 0.443299 | 0.666667 |
227 | PPS | 0.443182 | 0.686047 |
228 | NVA 2AD | 0.44186 | 0.813333 |
229 | 7MD | 0.44 | 0.659091 |
230 | B1U | 0.438776 | 0.648936 |
231 | KYE | 0.438776 | 0.719512 |
232 | XAH | 0.438776 | 0.659091 |
233 | 1DA | 0.438356 | 0.828571 |
234 | VRT | 0.436782 | 0.8 |
235 | SO8 | 0.436782 | 0.847222 |
236 | NOC | 0.43662 | 0.746479 |
237 | DQV | 0.435644 | 0.725 |
238 | TAD | 0.435644 | 0.694118 |
239 | KH3 | 0.435644 | 0.7625 |
240 | GTA | 0.435644 | 0.717647 |
241 | AMP DBH | 0.434343 | 0.7375 |
242 | 4UV | 0.434343 | 0.698795 |
243 | NX8 | 0.431818 | 0.74359 |
244 | V3L | 0.431818 | 0.734177 |
245 | 3NZ | 0.431579 | 0.789474 |
246 | AHZ | 0.431373 | 0.717647 |
247 | ERJ | 0.43038 | 0.788732 |
248 | 2A5 | 0.430233 | 0.674699 |
249 | NWZ | 0.430233 | 0.730769 |
250 | 7C5 | 0.43 | 0.734177 |
251 | G3A | 0.43 | 0.682353 |
252 | YLB | 0.428571 | 0.681818 |
253 | 48N | 0.427184 | 0.702381 |
254 | YLP | 0.427184 | 0.662921 |
255 | U4Y | 0.427184 | 0.789474 |
256 | 4UU | 0.425743 | 0.698795 |
257 | AR6 AR6 | 0.425743 | 0.75641 |
258 | ARG AMP | 0.425743 | 0.670455 |
259 | AFH | 0.425743 | 0.674419 |
260 | G5P | 0.425743 | 0.682353 |
261 | ATR | 0.425287 | 0.708861 |
262 | 7D4 | 0.423529 | 0.662651 |
263 | HY8 | 0.423077 | 0.7375 |
264 | 4UW | 0.423077 | 0.714286 |
265 | UP5 | 0.423077 | 0.698795 |
266 | AV2 | 0.422222 | 0.670732 |
267 | KXW | 0.421569 | 0.75641 |
268 | 4YB | 0.421569 | 0.652174 |
269 | OMR | 0.419048 | 0.689655 |
270 | WSA | 0.419048 | 0.674157 |
271 | ARJ | 0.418919 | 0.732394 |
272 | CUU | 0.418605 | 0.7125 |
273 | COD | 0.418182 | 0.715909 |
274 | HZ2 | 0.417476 | 0.7375 |
275 | LAQ | 0.417476 | 0.678161 |
276 | J4G | 0.416667 | 0.698795 |
277 | 4TC | 0.415094 | 0.682353 |
278 | YLC | 0.415094 | 0.678161 |
279 | AP0 | 0.415094 | 0.702381 |
280 | 8Q2 | 0.415094 | 0.645161 |
281 | LPA AMP | 0.413462 | 0.697674 |
282 | OZP | 0.413462 | 0.75641 |
283 | KOY | 0.413462 | 0.763158 |
284 | A2R | 0.413043 | 0.725 |
285 | TXD | 0.409524 | 0.710843 |
286 | DND | 0.409524 | 0.728395 |
287 | 6V0 | 0.409524 | 0.682353 |
288 | NAX | 0.409524 | 0.666667 |
289 | NAI | 0.409524 | 0.690476 |
290 | 101 | 0.407407 | 0.679012 |
291 | PLP AAD | 0.40708 | 0.758621 |
292 | V1N | 0.405941 | 0.734177 |
293 | 649 | 0.40566 | 0.638298 |
294 | TXE | 0.40566 | 0.690476 |
295 | AF3 ADP 3PG | 0.40566 | 0.694118 |
296 | N37 | 0.40566 | 0.74026 |
297 | TYM | 0.40566 | 0.707317 |
298 | ALF ADP 3PG | 0.40566 | 0.694118 |
299 | T5A | 0.40367 | 0.662921 |
300 | Q2V | 0.40367 | 0.746835 |
301 | F0P | 0.401869 | 0.75641 |
302 | NAD IBO | 0.401869 | 0.75641 |
303 | NAD TDB | 0.401869 | 0.75641 |
304 | L3W | 0.401869 | 0.707317 |
305 | Q2M | 0.401869 | 0.759494 |
306 | Q34 | 0.401869 | 0.719512 |
307 | UPA | 0.401869 | 0.690476 |
308 | 3AT | 0.4 | 0.7125 |
309 | AYB | 0.4 | 0.674157 |
310 | AFX | 0.4 | 0.662338 |
311 | CNA | 0.4 | 0.728395 |
312 | IVH | 0.4 | 0.772152 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | N8M | 0.9815 |
2 | MTI | 0.9791 |
3 | MTM | 0.9747 |
4 | MTH | 0.9703 |
5 | IMP | 0.9442 |
6 | 5NB | 0.9398 |
7 | NOS | 0.9386 |
8 | 5GP | 0.9253 |
9 | A8M | 0.9162 |
10 | TMP | 0.9153 |
11 | O8M | 0.9142 |
12 | TAL | 0.9131 |
13 | C5P | 0.9120 |
14 | U5P | 0.9120 |
15 | C | 0.9120 |
16 | GMP | 0.9114 |
17 | FMC | 0.9100 |
18 | 8GM | 0.9077 |
19 | RFZ | 0.9049 |
20 | UMP | 0.9033 |
21 | U | 0.9030 |
22 | F01 | 0.8982 |
23 | 8OG | 0.8977 |
24 | MCY | 0.8962 |
25 | THM | 0.8876 |
26 | I5A | 0.8867 |
27 | B86 | 0.8842 |
28 | CTN | 0.8819 |
29 | 0DN | 0.8812 |
30 | CAR | 0.8794 |
31 | URI | 0.8787 |
32 | SGP | 0.8765 |
33 | DUR | 0.8707 |
34 | 2TU | 0.8707 |
35 | 8HG | 0.8700 |
36 | 5BT | 0.8658 |
37 | AMZ | 0.8623 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 7CL | 1.0000 |
2 | BXO | 1.0000 |
3 | ETX | 1.0000 |
4 | 4HA | 1.0000 |
5 | XAP | 1.0000 |
6 | PE9 | 1.0000 |
7 | 5BR | 0.9969 |
8 | NBN | 0.9919 |
9 | 9A7 | 0.9851 |
10 | BUB | 0.9821 |
11 | O8Y | 0.9809 |
12 | HE2 | 0.9795 |
13 | BAL | 0.9759 |
14 | HP6 | 0.9754 |
15 | BBU | 0.9718 |
16 | 3CL | 0.9716 |
17 | 1KA | 0.9706 |
18 | 1SP | 0.9702 |
19 | BMD | 0.9690 |
20 | BUQ | 0.9689 |
21 | YIV | 0.9687 |
22 | CRD | 0.9686 |
23 | PXO | 0.9685 |
24 | EGD | 0.9663 |
25 | 0CL | 0.9644 |
26 | BUA | 0.9644 |
27 | SGL | 0.9642 |
28 | 3OH | 0.9641 |
29 | 9A4 | 0.9618 |
30 | ABU | 0.9613 |
31 | 266 | 0.9606 |
32 | 3BB | 0.9592 |
33 | 3GR | 0.9591 |
34 | BU4 | 0.9590 |
35 | SSN | 0.9589 |
36 | FW5 | 0.9581 |
37 | ITU | 0.9568 |
38 | 25T | 0.9540 |
39 | LEA | 0.9539 |
40 | GOL | 0.9521 |
41 | SLP | 0.9519 |
42 | GXV | 0.9513 |
43 | MMU | 0.9509 |
44 | SAR | 0.9505 |
45 | A8C | 0.9489 |
46 | SIN | 0.9484 |
47 | MTG | 0.9461 |
48 | 1DH | 0.9452 |
49 | 2HA | 0.9450 |
50 | MEU | 0.9428 |
51 | MSF | 0.9427 |
52 | 2RA | 0.9425 |
53 | MLA | 0.9395 |
54 | PG3 | 0.9371 |
55 | DAV | 0.9368 |
56 | 2KT | 0.9366 |
57 | AOA | 0.9364 |
58 | DSS | 0.9338 |
59 | DGY | 0.9338 |
60 | CYS | 0.9336 |
61 | IVA | 0.9320 |
62 | ABA | 0.9317 |
63 | AAE | 0.9314 |
64 | P2D | 0.9306 |
65 | C2N | 0.9303 |
66 | DCY | 0.9299 |
67 | PG0 | 0.9292 |
68 | MLI | 0.9291 |
69 | FUM | 0.9285 |
70 | HIU | 0.9274 |
71 | DSN | 0.9272 |
72 | MLM | 0.9271 |
73 | A3B | 0.9271 |
74 | SER | 0.9267 |
75 | 3SS | 0.9266 |
76 | D2P | 0.9261 |
77 | VKC | 0.9259 |
78 | DE2 | 0.9257 |
79 | MAE | 0.9252 |
80 | 24T | 0.9250 |
81 | MTD | 0.9247 |
82 | NMG | 0.9241 |
83 | C5J | 0.9236 |
84 | PRI | 0.9234 |
85 | 3PY | 0.9233 |
86 | DMG | 0.9229 |
87 | NVI | 0.9223 |
88 | HE4 | 0.9220 |
89 | ISU | 0.9216 |
90 | HX2 | 0.9215 |
91 | 03W | 0.9212 |
92 | DBB | 0.9211 |
93 | HTX | 0.9211 |
94 | H95 | 0.9208 |
95 | CHT | 0.9206 |
96 | MRY | 0.9206 |
97 | 4MV | 0.9205 |
98 | E60 | 0.9204 |
99 | SHF | 0.9197 |
100 | FJO | 0.9195 |
101 | GLY | 0.9192 |
102 | OCT | 0.9188 |
103 | 2HE | 0.9187 |
104 | LER | 0.9177 |
105 | HYN | 0.9172 |
106 | 23W | 0.9171 |
107 | 6NA | 0.9168 |
108 | 3HR | 0.9161 |
109 | HSE | 0.9158 |
110 | SHO | 0.9155 |
111 | CEJ | 0.9155 |
112 | IPU | 0.9149 |
113 | HV2 | 0.9143 |
114 | MZW | 0.9141 |
115 | HUI | 0.9141 |
116 | BP9 | 0.9141 |
117 | ETM | 0.9139 |
118 | HVQ | 0.9133 |
119 | OPE | 0.9132 |
120 | HDA | 0.9131 |
121 | SMB | 0.9122 |
122 | BVC | 0.9121 |
123 | TAU | 0.9120 |
124 | 3HL | 0.9120 |
125 | COM | 0.9114 |
126 | 9X7 | 0.9110 |
127 | XPO | 0.9097 |
128 | BHL | 0.9092 |
129 | BHL BHL | 0.9092 |
130 | 4SD | 0.9088 |
131 | EFS | 0.9088 |
132 | IHG | 0.9086 |
133 | THR | 0.9078 |
134 | 9YL | 0.9074 |
135 | HSM | 0.9073 |
136 | VX | 0.9069 |
137 | 69O | 0.9062 |
138 | F3V | 0.9060 |
139 | JZ5 | 0.9058 |
140 | MZ0 | 0.9053 |
141 | ATO | 0.9048 |
142 | DTU | 0.9048 |
143 | DTL | 0.9044 |
144 | POA | 0.9042 |
145 | KG7 | 0.9042 |
146 | DXX | 0.9040 |
147 | DQY | 0.9035 |
148 | NVA | 0.9031 |
149 | IQ0 | 0.9030 |
150 | OHG | 0.9023 |
151 | 8X3 | 0.9016 |
152 | OSM | 0.9011 |
153 | 39J | 0.9011 |
154 | BVG | 0.9009 |
155 | HCS | 0.9007 |
156 | OXL | 0.9007 |
157 | PPI | 0.9002 |
158 | P7I | 0.9000 |
159 | BTL | 0.8992 |
160 | PGA | 0.8989 |
161 | OXD | 0.8982 |
162 | 2EZ | 0.8981 |
163 | GOA | 0.8973 |
164 | FAH | 0.8966 |
165 | A20 | 0.8965 |
166 | AKR | 0.8965 |
167 | CSS | 0.8965 |
168 | 1BP | 0.8964 |
169 | OKG | 0.8961 |
170 | TZC | 0.8957 |
171 | R3W | 0.8955 |
172 | GLV | 0.8950 |
173 | XIX | 0.8948 |
174 | PRO | 0.8945 |
175 | SMV | 0.8944 |
176 | CP | 0.8943 |
177 | F50 | 0.8940 |
178 | NIE | 0.8940 |
179 | TFB | 0.8940 |
180 | HBR | 0.8939 |
181 | 1DU | 0.8934 |
182 | ORN | 0.8932 |
183 | HVB | 0.8925 |
184 | BRP | 0.8925 |
185 | AMC | 0.8924 |
186 | DCL | 0.8918 |
187 | PYR | 0.8917 |
188 | JBN | 0.8915 |
189 | 9SB | 0.8910 |
190 | C21 | 0.8908 |
191 | ALO | 0.8908 |
192 | 2A1 | 0.8906 |
193 | HAE | 0.8905 |
194 | PYC | 0.8897 |
195 | MZY | 0.8896 |
196 | LAC | 0.8896 |
197 | BRJ | 0.8894 |
198 | EDO | 0.8888 |
199 | COI | 0.8885 |
200 | HBS | 0.8882 |
201 | FCN | 0.8882 |
202 | DAL | 0.8874 |
203 | MLT | 0.8874 |
204 | 2OP | 0.8866 |
205 | KIV | 0.8860 |
206 | ALA | 0.8855 |
207 | VAL | 0.8853 |
208 | BAE | 0.8852 |
209 | ODV | 0.8846 |
210 | PRS | 0.8844 |
211 | IOM | 0.8843 |
212 | CRN | 0.8843 |
213 | CMS | 0.8839 |
214 | TEO | 0.8838 |
215 | 273 | 0.8836 |
216 | BUO | 0.8834 |
217 | CP2 | 0.8833 |
218 | XRG | 0.8830 |
219 | 2PC | 0.8829 |
220 | TB6 | 0.8826 |
221 | DTT | 0.8824 |
222 | LMR | 0.8823 |
223 | NMU | 0.8822 |
224 | SAT | 0.8822 |
225 | TP5 | 0.8816 |
226 | DAS | 0.8814 |
227 | ASP | 0.8812 |
228 | ALQ | 0.8807 |
229 | ATQ | 0.8804 |
230 | 265 | 0.8801 |
231 | AKB | 0.8801 |
232 | FOA | 0.8799 |
233 | OAA | 0.8798 |
234 | NOE | 0.8797 |
235 | 1CB | 0.8796 |
236 | 2MH | 0.8796 |
237 | PAE | 0.8793 |
238 | 7VD | 0.8790 |
239 | MPD | 0.8789 |
240 | OXM | 0.8788 |
241 | PCT | 0.8787 |
242 | UGC | 0.8785 |
243 | S0H | 0.8783 |
244 | ETF | 0.8780 |
245 | HBX | 0.8775 |
246 | PYF | 0.8771 |
247 | DPR | 0.8771 |
248 | DCE | 0.8769 |
249 | 2RH | 0.8767 |
250 | SYN | 0.8762 |
251 | ASN | 0.8761 |
252 | PY7 | 0.8760 |
253 | BXA | 0.8757 |
254 | BML | 0.8752 |
255 | DYA | 0.8748 |
256 | GUA | 0.8748 |
257 | 7WG | 0.8744 |
258 | TSZ | 0.8744 |
259 | HAI | 0.8741 |
260 | GXE | 0.8740 |
261 | CXL | 0.8736 |
262 | ABN | 0.8733 |
263 | FPI | 0.8732 |
264 | TAN | 0.8726 |
265 | MET | 0.8722 |
266 | 3MT | 0.8721 |
267 | HGY | 0.8721 |
268 | NAK | 0.8713 |
269 | NLE | 0.8708 |
270 | 6SP | 0.8708 |
271 | 2A3 | 0.8708 |
272 | BYZ | 0.8707 |
273 | IPH | 0.8705 |
274 | 1MR | 0.8704 |
275 | THE | 0.8701 |
276 | LEU | 0.8700 |
277 | CNH | 0.8700 |
278 | GLY GLY | 0.8699 |
279 | MGX | 0.8699 |
280 | V1L | 0.8693 |
281 | J3K | 0.8689 |
282 | UY7 | 0.8686 |
283 | 4CH | 0.8684 |
284 | CYH | 0.8682 |
285 | PYZ | 0.8680 |
286 | TB0 | 0.8678 |
287 | 4MZ | 0.8676 |
288 | QPT | 0.8670 |
289 | PCA | 0.8669 |
290 | 282 | 0.8668 |
291 | 2IM | 0.8667 |
292 | B24 | 0.8667 |
293 | 3BR | 0.8667 |
294 | JYD | 0.8667 |
295 | GBL | 0.8657 |
296 | NHY | 0.8655 |
297 | ES3 | 0.8652 |
298 | HYP | 0.8649 |
299 | PYJ | 0.8645 |
300 | VSO | 0.8641 |
301 | HZP | 0.8633 |
302 | T2C | 0.8631 |
303 | PPF | 0.8619 |
304 | XBT | 0.8619 |
305 | BAQ | 0.8617 |
306 | URP | 0.8616 |
307 | ICN | 0.8606 |
308 | FQI | 0.8601 |
309 | 1AC | 0.8596 |
310 | CB0 | 0.8596 |
311 | NBE | 0.8590 |
312 | ZBT | 0.8585 |
313 | PAH | 0.8578 |
314 | BHH | 0.8573 |
315 | APY | 0.8569 |
316 | HPY | 0.8565 |
317 | OK7 | 0.8564 |
318 | CXF | 0.8559 |
319 | MMQ | 0.8554 |
320 | 192 | 0.8550 |
321 | RSO | 0.8546 |
322 | 14J | 0.8540 |
323 | IZC | 0.8513 |
This union binding pocket(no: 1) in the query (biounit: 3dz6.bio1) has 10 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3dz6.bio1) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |