- Navigate
- Expand All | Collapse All
- Receptor | Ligand | View in 3D
- Family: 90% | 70% | 50% | site
- External Links
- |
- Download
- 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 | 1GXZ | - | BRT | C6 H5 Br N2 O | c1c(cncc1B.... |
2 | 1OG1 | - | TAD | C20 H27 N7 O13 P2 S | c1c(nc(s1).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 1GXZ | - | BRT | C6 H5 Br N2 O | c1c(cncc1B.... |
2 | 1OG1 | - | TAD | C20 H27 N7 O13 P2 S | c1c(nc(s1).... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | TAD | 1 | 1 |
2 | ADV | 0.659794 | 0.923077 |
3 | RBY | 0.659794 | 0.923077 |
4 | APC | 0.632653 | 0.923077 |
5 | A12 | 0.631579 | 0.923077 |
6 | AP2 | 0.631579 | 0.923077 |
7 | A | 0.578947 | 0.858974 |
8 | AMP | 0.578947 | 0.858974 |
9 | CA0 | 0.564356 | 0.886076 |
10 | A2D | 0.561224 | 0.884615 |
11 | ABM | 0.561224 | 0.8375 |
12 | 45A | 0.561224 | 0.8375 |
13 | KG4 | 0.558824 | 0.886076 |
14 | ACP | 0.558824 | 0.910256 |
15 | AMP MG | 0.556701 | 0.846154 |
16 | ACQ | 0.552381 | 0.910256 |
17 | 8LH | 0.551402 | 0.851852 |
18 | BA3 | 0.55 | 0.884615 |
19 | M33 | 0.54902 | 0.873418 |
20 | ADX | 0.54902 | 0.823529 |
21 | 5AL | 0.54717 | 0.873418 |
22 | V2G | 0.54717 | 0.843373 |
23 | B4P | 0.544554 | 0.884615 |
24 | ADP | 0.544554 | 0.884615 |
25 | AP5 | 0.544554 | 0.884615 |
26 | 8LQ | 0.541284 | 0.875 |
27 | SRA | 0.540816 | 0.8625 |
28 | AN2 | 0.539216 | 0.873418 |
29 | AT4 | 0.539216 | 0.898734 |
30 | AR6 | 0.538462 | 0.884615 |
31 | APR | 0.538462 | 0.884615 |
32 | GAP | 0.537736 | 0.839506 |
33 | 6YZ | 0.537037 | 0.910256 |
34 | 9ZD | 0.536364 | 0.831325 |
35 | 9ZA | 0.536364 | 0.831325 |
36 | 8QN | 0.536364 | 0.873418 |
37 | AU1 | 0.533981 | 0.8625 |
38 | APC MG | 0.533333 | 0.884615 |
39 | 8LE | 0.53271 | 0.841463 |
40 | 4AD | 0.531532 | 0.8875 |
41 | WAQ | 0.530973 | 0.876543 |
42 | DQV | 0.529412 | 0.897436 |
43 | 50T | 0.528846 | 0.85 |
44 | ATP | 0.528846 | 0.884615 |
45 | HEJ | 0.528846 | 0.884615 |
46 | QA7 | 0.527273 | 0.841463 |
47 | DAL AMP | 0.527273 | 0.85 |
48 | ADP MG | 0.524272 | 0.858974 |
49 | SON | 0.524272 | 0.898734 |
50 | ADP BEF | 0.524272 | 0.858974 |
51 | 5FA | 0.52381 | 0.884615 |
52 | AQP | 0.52381 | 0.884615 |
53 | PRX | 0.52381 | 0.817073 |
54 | T99 | 0.523364 | 0.898734 |
55 | TAT | 0.523364 | 0.898734 |
56 | SRP | 0.522936 | 0.875 |
57 | AGS | 0.518868 | 0.8875 |
58 | ADP PO3 | 0.518868 | 0.858974 |
59 | AD9 | 0.518868 | 0.8625 |
60 | ATP MG | 0.518868 | 0.858974 |
61 | HQG | 0.518182 | 0.873418 |
62 | AMO | 0.517857 | 0.898734 |
63 | PAJ | 0.517857 | 0.833333 |
64 | DZD | 0.515625 | 0.901235 |
65 | ANP | 0.509259 | 0.8625 |
66 | OOB | 0.508929 | 0.873418 |
67 | PR8 | 0.504348 | 0.845238 |
68 | LAD | 0.504348 | 0.855422 |
69 | B5V | 0.504348 | 0.851852 |
70 | ANP MG | 0.5 | 0.85 |
71 | DLL | 0.5 | 0.873418 |
72 | 1ZZ | 0.5 | 0.813953 |
73 | MAP | 0.5 | 0.841463 |
74 | 00A | 0.5 | 0.831325 |
75 | ATF | 0.5 | 0.851852 |
76 | AHX | 0.5 | 0.865854 |
77 | BEF ADP | 0.5 | 0.8375 |
78 | TXA | 0.5 | 0.875 |
79 | LMS | 0.5 | 0.781609 |
80 | PTJ | 0.5 | 0.821429 |
81 | JNT | 0.5 | 0.886076 |
82 | XAH | 0.495798 | 0.835294 |
83 | MYR AMP | 0.495726 | 0.793103 |
84 | OAD | 0.495652 | 0.886076 |
85 | 3UK | 0.495652 | 0.8625 |
86 | 5SV | 0.495575 | 0.8 |
87 | OZV | 0.495575 | 0.884615 |
88 | 3DH | 0.494949 | 0.728395 |
89 | A3R | 0.491228 | 0.876543 |
90 | A1R | 0.491228 | 0.876543 |
91 | AHZ | 0.487805 | 0.857143 |
92 | B5Y | 0.487395 | 0.841463 |
93 | ME8 | 0.487179 | 0.835294 |
94 | 3OD | 0.487179 | 0.886076 |
95 | NB8 | 0.487179 | 0.865854 |
96 | A22 | 0.486726 | 0.873418 |
97 | VO4 ADP | 0.486486 | 0.839506 |
98 | ALF ADP | 0.486486 | 0.797619 |
99 | ARG AMP | 0.483607 | 0.784091 |
100 | 9X8 | 0.482759 | 0.8875 |
101 | 25A | 0.482456 | 0.860759 |
102 | 4UV | 0.479339 | 0.841463 |
103 | 9SN | 0.478992 | 0.821429 |
104 | ADQ | 0.478261 | 0.8625 |
105 | LAQ | 0.475806 | 0.879518 |
106 | B5M | 0.475 | 0.841463 |
107 | FA5 | 0.475 | 0.875 |
108 | BIS | 0.474576 | 0.831325 |
109 | TSB | 0.473684 | 0.795455 |
110 | A5A | 0.473214 | 0.784091 |
111 | O02 | 0.472727 | 0.888889 |
112 | G5A | 0.472727 | 0.777778 |
113 | 5X8 | 0.472222 | 0.7625 |
114 | LPA AMP | 0.472 | 0.857143 |
115 | GA7 | 0.471545 | 0.851852 |
116 | 4UU | 0.471545 | 0.841463 |
117 | 7MD | 0.471545 | 0.835294 |
118 | 6V0 | 0.468254 | 0.843373 |
119 | 4UW | 0.468254 | 0.811765 |
120 | VMS | 0.464912 | 0.766667 |
121 | 54H | 0.464912 | 0.766667 |
122 | OMR | 0.464567 | 0.825581 |
123 | FYA | 0.462185 | 0.85 |
124 | AOC | 0.461538 | 0.75 |
125 | DSH | 0.461538 | 0.72619 |
126 | L3W | 0.460938 | 0.875 |
127 | 8X1 | 0.46087 | 0.752688 |
128 | 48N | 0.460317 | 0.865854 |
129 | YLP | 0.460317 | 0.816092 |
130 | 25L | 0.458333 | 0.873418 |
131 | 5AS | 0.457944 | 0.73913 |
132 | ADP BMA | 0.457627 | 0.839506 |
133 | NAI | 0.456693 | 0.853659 |
134 | NAX | 0.456693 | 0.845238 |
135 | TXD | 0.456693 | 0.853659 |
136 | SSA | 0.45614 | 0.797753 |
137 | AMP DBH | 0.455285 | 0.817073 |
138 | F2R | 0.454545 | 0.816092 |
139 | 5CD | 0.453608 | 0.734177 |
140 | TXE | 0.453125 | 0.853659 |
141 | DSZ | 0.452991 | 0.797753 |
142 | LSS | 0.452991 | 0.76087 |
143 | NSS | 0.452991 | 0.797753 |
144 | XYA | 0.452632 | 0.769231 |
145 | RAB | 0.452632 | 0.769231 |
146 | ADN | 0.452632 | 0.769231 |
147 | 52H | 0.452174 | 0.758242 |
148 | KMQ | 0.45082 | 0.851852 |
149 | ATP A A A | 0.45082 | 0.848101 |
150 | ATP A | 0.45082 | 0.848101 |
151 | DTA | 0.45 | 0.7625 |
152 | JB6 | 0.45 | 0.876543 |
153 | YLC | 0.449612 | 0.835294 |
154 | 4TC | 0.449612 | 0.888889 |
155 | YLB | 0.449612 | 0.816092 |
156 | 7MC | 0.449612 | 0.816092 |
157 | 5CA | 0.448276 | 0.797753 |
158 | 53H | 0.448276 | 0.758242 |
159 | TIZ | 0.446809 | 0.653846 |
160 | DND | 0.445312 | 0.875 |
161 | M24 | 0.445255 | 0.802326 |
162 | IMO | 0.443396 | 0.822785 |
163 | 5N5 | 0.443299 | 0.746835 |
164 | IOT | 0.442748 | 0.806818 |
165 | ALF ADP 3PG | 0.44186 | 0.811765 |
166 | TYM | 0.44186 | 0.875 |
167 | P5A | 0.441667 | 0.763441 |
168 | KAA | 0.441667 | 0.771739 |
169 | GSU | 0.441667 | 0.777778 |
170 | G3A | 0.44 | 0.843373 |
171 | YLA | 0.439394 | 0.816092 |
172 | S4M | 0.439252 | 0.67033 |
173 | A4D | 0.438776 | 0.769231 |
174 | NAD TDB | 0.438462 | 0.860759 |
175 | AP0 | 0.438462 | 0.821429 |
176 | NAD IBO | 0.438462 | 0.860759 |
177 | BT5 | 0.437037 | 0.870588 |
178 | NVA LMS | 0.436975 | 0.752688 |
179 | AFH | 0.436508 | 0.833333 |
180 | AR6 AR6 | 0.436508 | 0.8375 |
181 | G5P | 0.436508 | 0.843373 |
182 | CNA | 0.43609 | 0.875 |
183 | AYB | 0.43609 | 0.806818 |
184 | 38V | 0.435714 | 0.879518 |
185 | M2T | 0.435644 | 0.694118 |
186 | A3P | 0.435185 | 0.858974 |
187 | UP5 | 0.434109 | 0.864198 |
188 | 80F | 0.433824 | 0.858824 |
189 | SAH | 0.433628 | 0.765432 |
190 | LEU LMS | 0.433333 | 0.731183 |
191 | GTA | 0.433071 | 0.813953 |
192 | H1Q | 0.432432 | 0.825 |
193 | D4F | 0.431655 | 0.879518 |
194 | MTA | 0.431373 | 0.728395 |
195 | AF3 ADP 3PG | 0.430769 | 0.811765 |
196 | NAD | 0.42963 | 0.873418 |
197 | AMP NAD | 0.42963 | 0.85 |
198 | 7D5 | 0.427184 | 0.802469 |
199 | 9K8 | 0.42623 | 0.715789 |
200 | GJV | 0.425926 | 0.689655 |
201 | EP4 | 0.425743 | 0.690476 |
202 | 6RE | 0.424528 | 0.697674 |
203 | A4P | 0.424242 | 0.777778 |
204 | YSA | 0.424 | 0.777778 |
205 | A2P | 0.422018 | 0.846154 |
206 | NAJ PZO | 0.42029 | 0.8 |
207 | SLU | 0.42029 | 0.808989 |
208 | BTX | 0.419118 | 0.880952 |
209 | COD | 0.419118 | 0.829545 |
210 | 3AM | 0.419048 | 0.822785 |
211 | SMM | 0.418803 | 0.707865 |
212 | NAQ | 0.41844 | 0.821429 |
213 | 139 | 0.41791 | 0.845238 |
214 | V3L | 0.417391 | 0.860759 |
215 | SAM | 0.417391 | 0.712644 |
216 | 7C5 | 0.417323 | 0.75 |
217 | 5AD | 0.416667 | 0.679487 |
218 | J7C | 0.416667 | 0.705882 |
219 | UPA | 0.416667 | 0.853659 |
220 | 8PZ | 0.416 | 0.797753 |
221 | ZID | 0.415493 | 0.8625 |
222 | KOY | 0.415385 | 0.756098 |
223 | O05 | 0.414634 | 0.818182 |
224 | A7D | 0.414414 | 0.775 |
225 | YLY | 0.414286 | 0.806818 |
226 | PPS | 0.413793 | 0.802326 |
227 | A3D | 0.413043 | 0.8625 |
228 | B1U | 0.412698 | 0.71875 |
229 | PAP | 0.412281 | 0.871795 |
230 | FB0 | 0.412162 | 0.802198 |
231 | NAE | 0.411348 | 0.841463 |
232 | 4YB | 0.410853 | 0.76087 |
233 | NWW | 0.41 | 0.714286 |
234 | QXG | 0.409836 | 0.736264 |
235 | EAD | 0.409722 | 0.823529 |
236 | WSA | 0.409091 | 0.786517 |
237 | 649 | 0.409091 | 0.763441 |
238 | NAJ PYZ | 0.408451 | 0.764045 |
239 | QXP | 0.408333 | 0.744444 |
240 | ADJ | 0.407407 | 0.804598 |
241 | T5A | 0.407407 | 0.837209 |
242 | SFG | 0.40708 | 0.75 |
243 | J4G | 0.406504 | 0.864198 |
244 | N0B | 0.405594 | 0.816092 |
245 | A3N | 0.40367 | 0.719512 |
246 | 2A5 | 0.403509 | 0.839506 |
247 | A2R | 0.403361 | 0.873418 |
248 | SXZ | 0.403226 | 0.732558 |
249 | ZAS | 0.401869 | 0.702381 |
250 | AAT | 0.401709 | 0.729412 |
251 | EEM | 0.401709 | 0.693182 |
252 | ARU | 0.401639 | 0.770115 |
253 | A5D | 0.4 | 0.7625 |
254 | 7D3 | 0.4 | 0.82716 |
255 | SA8 | 0.4 | 0.709302 |
256 | 6MZ | 0.4 | 0.825 |
257 | ATR | 0.4 | 0.858974 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 1og1.bio1) has 23 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4FXQ | G9L | 4.86726 |
2 | 4FK7 | P34 | 4.86726 |