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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 1KND | - | TBU | C4 H10 O | CC(C)(C)O |
2 | 1KMY | Kd = 8 uM | BPY | C12 H10 O2 | c1ccc(cc1).... |
3 | 1LKD | - | BP6 | C12 H8 Cl2 O2 | c1cc(c(c(c.... |
4 | 1LGT | Kd = 0.8 uM | BP3 | C12 H9 Cl O2 | c1ccc(c(c1.... |
5 | 1KNF | - | MBD | C7 H8 O2 | Cc1cccc(c1.... |
6 | 1HAN | - | TBU | C4 H10 O | CC(C)(C)O |
7 | 1KW6 | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
8 | 1KW8 | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
9 | 1EIR | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
10 | 1KWC | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
11 | 1KW9 | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1KND | - | TBU | C4 H10 O | CC(C)(C)O |
2 | 1KMY | Kd = 8 uM | BPY | C12 H10 O2 | c1ccc(cc1).... |
3 | 1LKD | - | BP6 | C12 H8 Cl2 O2 | c1cc(c(c(c.... |
4 | 1LGT | Kd = 0.8 uM | BP3 | C12 H9 Cl O2 | c1ccc(c(c1.... |
5 | 1KNF | - | MBD | C7 H8 O2 | Cc1cccc(c1.... |
6 | 1HAN | - | TBU | C4 H10 O | CC(C)(C)O |
7 | 2WL9 | - | MBD | C7 H8 O2 | Cc1cccc(c1.... |
8 | 1KW6 | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
9 | 1KW8 | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
10 | 1EIR | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
11 | 1KWC | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
12 | 1KW9 | - | BPY | C12 H10 O2 | c1ccc(cc1).... |
13 | 2ZI8 | - | SDT | C19 H24 O4 | Cc1ccc(c(c.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 2JM | 0.9553 |
2 | WOE | 0.9538 |
3 | SV4 | 0.9533 |
4 | L13 | 0.9531 |
5 | CK2 | 0.9507 |
6 | 6HX | 0.9491 |
7 | XDK | 0.9485 |
8 | BNL | 0.9455 |
9 | JRB | 0.9430 |
10 | CK1 | 0.9426 |
11 | N3W | 0.9414 |
12 | 5VL | 0.9408 |
13 | PJW | 0.9385 |
14 | B2T | 0.9385 |
15 | DC5 | 0.9381 |
16 | 977 | 0.9360 |
17 | C0H | 0.9330 |
18 | HNK | 0.9324 |
19 | CH9 | 0.9319 |
20 | WVV | 0.9311 |
21 | 6J9 | 0.9309 |
22 | HNH | 0.9300 |
23 | S0G | 0.9293 |
24 | B2Y | 0.9291 |
25 | M3E | 0.9279 |
26 | W29 | 0.9273 |
27 | B4O | 0.9270 |
28 | X48 | 0.9267 |
29 | TT4 | 0.9256 |
30 | H70 | 0.9254 |
31 | 2GD | 0.9252 |
32 | 3Y7 | 0.9245 |
33 | TCC | 0.9221 |
34 | BZE | 0.9212 |
35 | 54X | 0.9208 |
36 | 50C | 0.9207 |
37 | PBQ | 0.9203 |
38 | 1WC | 0.9198 |
39 | MPK | 0.9198 |
40 | F16 | 0.9197 |
41 | JF6 | 0.9190 |
42 | GVG | 0.9189 |
43 | NCT | 0.9187 |
44 | FMQ | 0.9182 |
45 | OBP | 0.9177 |
46 | C53 | 0.9176 |
47 | A9K | 0.9174 |
48 | A7K | 0.9170 |
49 | BY5 | 0.9167 |
50 | 46P | 0.9164 |
51 | 1XA | 0.9159 |
52 | X6P | 0.9159 |
53 | EAJ | 0.9158 |
54 | HNL | 0.9157 |
55 | SOV | 0.9153 |
56 | A9P | 0.9142 |
57 | 4PN | 0.9142 |
58 | SQ4 | 0.9135 |
59 | 5UD | 0.9120 |
60 | 22L | 0.9119 |
61 | AOT | 0.9117 |
62 | SQ7 | 0.9114 |
63 | 49O | 0.9110 |
64 | 6J3 | 0.9105 |
65 | KF5 | 0.9103 |
66 | 38B | 0.9101 |
67 | N8Z | 0.9099 |
68 | U2Z | 0.9091 |
69 | S3C | 0.9090 |
70 | AVA | 0.9088 |
71 | HFA | 0.9084 |
72 | 9FH | 0.9074 |
73 | PHE | 0.9074 |
74 | 1VK | 0.9073 |
75 | CC5 | 0.9072 |
76 | MEX | 0.9068 |
77 | J9Q | 0.9062 |
78 | XFE | 0.9060 |
79 | T2D | 0.9059 |
80 | TLF | 0.9055 |
81 | K80 | 0.9050 |
82 | A4N | 0.9047 |
83 | A4T | 0.9043 |
84 | 16Z | 0.9033 |
85 | FB4 | 0.9031 |
86 | 92G | 0.9030 |
87 | DPN | 0.9028 |
88 | FTV | 0.9027 |
89 | DAH | 0.9024 |
90 | GN6 | 0.9019 |
91 | HIC | 0.9018 |
92 | AWE | 0.9016 |
93 | DNB | 0.9013 |
94 | GF4 | 0.9011 |
95 | F69 | 0.9010 |
96 | SAF | 0.9004 |
97 | RVE | 0.9004 |
98 | TI7 | 0.9002 |
99 | RUY | 0.9002 |
100 | TCL | 0.8999 |
101 | XYP XIF | 0.8997 |
102 | XIF XYP | 0.8997 |
103 | DTR | 0.8997 |
104 | F5F | 0.8995 |
105 | 2KU | 0.8992 |
106 | 7R4 | 0.8991 |
107 | 2TU | 0.8991 |
108 | AUV | 0.8989 |
109 | CH8 | 0.8985 |
110 | 4LV | 0.8985 |
111 | TR4 | 0.8981 |
112 | 78U | 0.8981 |
113 | 54E | 0.8981 |
114 | TRP | 0.8981 |
115 | 52C | 0.8980 |
116 | CLU | 0.8979 |
117 | A9O | 0.8977 |
118 | BPS | 0.8976 |
119 | MMS | 0.8975 |
120 | THU | 0.8975 |
121 | 89J | 0.8970 |
122 | KYN | 0.8966 |
123 | C2M | 0.8962 |
124 | A4B | 0.8962 |
125 | 5AE | 0.8961 |
126 | S2P | 0.8959 |
127 | 79W | 0.8958 |
128 | CTN | 0.8954 |
129 | N2Z | 0.8950 |
130 | 7ZL | 0.8946 |
131 | 1FL | 0.8943 |
132 | PFF | 0.8937 |
133 | TYR | 0.8933 |
134 | DTY | 0.8933 |
135 | NFA | 0.8932 |
136 | FPL | 0.8931 |
137 | MJ5 | 0.8931 |
138 | 9FG | 0.8926 |
139 | 3VW | 0.8921 |
140 | 3TC | 0.8920 |
141 | 61O | 0.8915 |
142 | 0QW | 0.8910 |
143 | 1FF | 0.8900 |
144 | BCK | 0.8900 |
145 | A4Q | 0.8898 |
146 | BP7 | 0.8896 |
147 | HL4 | 0.8894 |
148 | 8UY | 0.8889 |
149 | PPY | 0.8886 |
150 | MSR | 0.8886 |
151 | CP7 | 0.8883 |
152 | 6HO | 0.8880 |
153 | 3IL | 0.8879 |
154 | 2B4 | 0.8878 |
155 | X29 | 0.8877 |
156 | A6H | 0.8874 |
157 | ENO | 0.8872 |
158 | CPZ | 0.8869 |
159 | 9W5 | 0.8868 |
160 | ID8 | 0.8866 |
161 | FHC | 0.8864 |
162 | DCZ | 0.8863 |
163 | 1CY | 0.8862 |
164 | 9PL | 0.8861 |
165 | 4BF | 0.8857 |
166 | J27 | 0.8856 |
167 | ZYW | 0.8855 |
168 | 0OL | 0.8855 |
169 | AMQ | 0.8850 |
170 | SQP | 0.8849 |
171 | SQV | 0.8849 |
172 | AUT | 0.8845 |
173 | BRH | 0.8844 |
174 | GZQ | 0.8842 |
175 | TOH | 0.8839 |
176 | 7Q1 | 0.8838 |
177 | TZM | 0.8837 |
178 | R9G | 0.8836 |
179 | KWB | 0.8834 |
180 | 5AD | 0.8833 |
181 | M5E | 0.8831 |
182 | Q4G | 0.8830 |
183 | I5A | 0.8827 |
184 | QZ8 | 0.8824 |
185 | FWD | 0.8822 |
186 | URI | 0.8822 |
187 | 7QS | 0.8818 |
188 | MIL | 0.8816 |
189 | KP2 | 0.8816 |
190 | AMR | 0.8816 |
191 | J47 | 0.8815 |
192 | 25O | 0.8811 |
193 | MUR | 0.8806 |
194 | 1SF | 0.8805 |
195 | GFE | 0.8805 |
196 | DKZ | 0.8804 |
197 | JMS | 0.8800 |
198 | CUT | 0.8799 |
199 | M6H | 0.8795 |
200 | 3QO | 0.8795 |
201 | S2T | 0.8792 |
202 | ARJ | 0.8791 |
203 | CP6 | 0.8790 |
204 | DKX | 0.8788 |
205 | 2UB | 0.8780 |
206 | GL7 | 0.8779 |
207 | 8OB | 0.8776 |
208 | 3RP | 0.8771 |
209 | 0GA | 0.8769 |
210 | DUR | 0.8769 |
211 | H7S | 0.8767 |
212 | CJB | 0.8766 |
213 | 2LT | 0.8764 |
214 | LNR | 0.8762 |
215 | LJ3 | 0.8754 |
216 | BQ5 | 0.8751 |
217 | PYU | 0.8750 |
218 | XDN XYP | 0.8749 |
219 | XYP XDN | 0.8749 |
220 | XDL XYP | 0.8749 |
221 | 54F | 0.8748 |
222 | SLY | 0.8746 |
223 | 0OK | 0.8744 |
224 | AOJ | 0.8743 |
225 | TYC | 0.8742 |
226 | 4FP | 0.8740 |
227 | 2CZ | 0.8739 |
228 | C1M | 0.8738 |
229 | EF2 | 0.8737 |
230 | PZ8 | 0.8737 |
231 | GL5 | 0.8736 |
232 | SOR | 0.8733 |
233 | NOS | 0.8733 |
234 | HHH | 0.8730 |
235 | G14 | 0.8730 |
236 | OX2 | 0.8728 |
237 | 56D | 0.8728 |
238 | THM | 0.8727 |
239 | ADN | 0.8719 |
240 | 5E4 | 0.8719 |
241 | YZM | 0.8716 |
242 | H75 | 0.8715 |
243 | 8NX | 0.8714 |
244 | CTE | 0.8711 |
245 | HX8 | 0.8707 |
246 | 8CB | 0.8707 |
247 | 8OE | 0.8706 |
248 | 2LX | 0.8704 |
249 | 6EL | 0.8703 |
250 | PW1 | 0.8700 |
251 | L5D | 0.8697 |
252 | SNU | 0.8694 |
253 | 5F8 | 0.8692 |
254 | AU8 | 0.8691 |
255 | S1D | 0.8688 |
256 | TIH | 0.8687 |
257 | TYU | 0.8685 |
258 | F06 | 0.8683 |
259 | C82 | 0.8680 |
260 | 42R | 0.8678 |
261 | 6W6 | 0.8675 |
262 | A3Q | 0.8673 |
263 | N2Y | 0.8673 |
264 | 64I | 0.8672 |
265 | QME | 0.8669 |
266 | 3CA | 0.8668 |
267 | GL2 | 0.8668 |
268 | JA3 | 0.8667 |
269 | 6TZ | 0.8666 |
270 | 1BN | 0.8664 |
271 | DHC | 0.8661 |
272 | 5I5 | 0.8659 |
273 | 1KN | 0.8657 |
274 | VBC | 0.8657 |
275 | HIS | 0.8656 |
276 | 6XI | 0.8656 |
277 | GLS | 0.8655 |
278 | EXD | 0.8654 |
279 | F1X | 0.8647 |
280 | 1U7 | 0.8647 |
281 | 4MP | 0.8647 |
282 | STT | 0.8646 |
283 | 6DE | 0.8644 |
284 | 4XF | 0.8644 |
285 | F4K | 0.8641 |
286 | 1A5 | 0.8641 |
287 | TGW | 0.8640 |
288 | IQQ | 0.8640 |
289 | GPU | 0.8638 |
290 | 6J5 | 0.8633 |
291 | IOS | 0.8632 |
292 | 0OY | 0.8631 |
293 | 791 | 0.8631 |
294 | 3WJ | 0.8628 |
295 | JSX | 0.8624 |
296 | 4GP | 0.8620 |
297 | PIR | 0.8620 |
298 | TBN | 0.8619 |
299 | Z15 | 0.8615 |
300 | AX3 | 0.8614 |
301 | JTH | 0.8613 |
302 | NIY | 0.8612 |
303 | 3C4 | 0.8612 |
304 | CFA | 0.8609 |
305 | 9H2 | 0.8609 |
306 | 57O | 0.8608 |
307 | 293 | 0.8608 |
308 | NAG | 0.8607 |
309 | OQC | 0.8606 |
310 | 6ZX | 0.8600 |
311 | TZF | 0.8600 |
312 | IAC | 0.8598 |
313 | 3AD | 0.8597 |
314 | XYP XYP | 0.8594 |
315 | 0K7 | 0.8593 |
316 | 8GK | 0.8592 |
317 | EAT | 0.8590 |
318 | FUD | 0.8588 |
319 | 5FL | 0.8579 |
320 | N1E | 0.8577 |
321 | GPK | 0.8576 |
322 | FA1 | 0.8573 |
323 | PMP | 0.8568 |
324 | Y70 | 0.8560 |
325 | JO5 | 0.8555 |
326 | 6DP | 0.8552 |
327 | G6P | 0.8545 |
328 | PLP | 0.8545 |
329 | GPQ | 0.8541 |
330 | GEO | 0.8540 |
This union binding pocket(no: 1) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 7) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 8) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 9) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 10) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 11) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 12) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 13) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 14) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 15) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 16) in the query (biounit: 1lgt.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |