- 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 197 families. | |||||
1 | 4U54 | Kd = 8.7 mM | 3C5 | C13 H14 N2 | CNCc1cccc(.... |
2 | 4U5U | Kd = 1.3 mM | 3D2 | C18 H24 N4 O | c1cc(cc(c1.... |
3 | 4U5V | Kd = 0.9 mM | RH2 | C16 H22 N4 O S | c1cc(cnc1).... |
4 | 4U5N | Kd = 3.3 mM | 3D4 | C33 H45 N7 O5 | C[C@H]([C@.... |
5 | 4U5O | Kd = 3.8 mM | 3D5 | C18 H24 N4 O | c1cc(cnc1).... |
6 | 1Y2A | Kd ~ 45.8 nM | GLY LYS ILE SER LYS HIS TRP THR GLY ILE | n/a | n/a |
7 | 4U5S | Kd = 3.9 mM | 3D0 | C30 H45 N7 O6 | C[C@@H]([C.... |
8 | 6D7M | - | SIN | C4 H6 O4 | C(CC(=O)O).... |
9 | 3OQS | - | VAL LYS VAL VAL ALA LYS LYS TYR ARG ASN | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 165 families. | |||||
1 | 4RXH | Kd = 1.23 uM | PRO PRO LYS LYS LYS ARG LYS VAL | n/a | n/a |
2 | 1EE4 | - | PRO ALA ALA LYS ARG VAL LYS LEU ASP | n/a | n/a |
3 | 4U54 | Kd = 8.7 mM | 3C5 | C13 H14 N2 | CNCc1cccc(.... |
4 | 4U5U | Kd = 1.3 mM | 3D2 | C18 H24 N4 O | c1cc(cc(c1.... |
5 | 4U5V | Kd = 0.9 mM | RH2 | C16 H22 N4 O S | c1cc(cnc1).... |
6 | 4U5N | Kd = 3.3 mM | 3D4 | C33 H45 N7 O5 | C[C@H]([C@.... |
7 | 4U5O | Kd = 3.8 mM | 3D5 | C18 H24 N4 O | c1cc(cnc1).... |
8 | 1Y2A | Kd ~ 45.8 nM | GLY LYS ILE SER LYS HIS TRP THR GLY ILE | n/a | n/a |
9 | 4U5S | Kd = 3.9 mM | 3D0 | C30 H45 N7 O6 | C[C@@H]([C.... |
10 | 6D7M | - | SIN | C4 H6 O4 | C(CC(=O)O).... |
11 | 3OQS | - | VAL LYS VAL VAL ALA LYS LYS TYR ARG ASN | n/a | n/a |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | D1G | 0.9539 |
2 | LEL | 0.9493 |
3 | V2Z | 0.9479 |
4 | 795 | 0.9479 |
5 | 0LO | 0.9462 |
6 | X6P | 0.9457 |
7 | X6W | 0.9448 |
8 | 6NZ | 0.9439 |
9 | 0NX | 0.9437 |
10 | 5F8 | 0.9427 |
11 | MMJ | 0.9420 |
12 | AVA | 0.9408 |
13 | LNN | 0.9395 |
14 | AED | 0.9391 |
15 | WVV | 0.9370 |
16 | D3G | 0.9369 |
17 | AUV | 0.9368 |
18 | 5FL | 0.9366 |
19 | Q4G | 0.9340 |
20 | F63 | 0.9339 |
21 | VM1 | 0.9336 |
22 | B2T | 0.9334 |
23 | A9B | 0.9330 |
24 | 0K7 | 0.9310 |
25 | YE6 | 0.9309 |
26 | 28B | 0.9309 |
27 | 8CC | 0.9297 |
28 | U7E | 0.9290 |
29 | L5D | 0.9288 |
30 | M4N | 0.9286 |
31 | UN3 | 0.9281 |
32 | A7Q | 0.9275 |
33 | IQQ | 0.9256 |
34 | 49P | 0.9256 |
35 | 4FF | 0.9249 |
36 | 7KE | 0.9248 |
37 | 5C1 | 0.9245 |
38 | NK5 | 0.9245 |
39 | S1D | 0.9240 |
40 | JSX | 0.9240 |
41 | XI7 | 0.9240 |
42 | 1ER | 0.9235 |
43 | R20 | 0.9232 |
44 | KWH | 0.9227 |
45 | XDK | 0.9226 |
46 | VBC | 0.9226 |
47 | 5F5 | 0.9218 |
48 | HKK | 0.9213 |
49 | 5TZ | 0.9205 |
50 | L1T | 0.9204 |
51 | K4T | 0.9191 |
52 | 28A | 0.9185 |
53 | 3GV | 0.9180 |
54 | BZE | 0.9167 |
55 | KWB | 0.9165 |
56 | HQJ | 0.9165 |
57 | FCD | 0.9163 |
58 | LFQ | 0.9161 |
59 | L5V | 0.9155 |
60 | 78Y | 0.9150 |
61 | 7G2 | 0.9144 |
62 | L22 | 0.9142 |
63 | HHB | 0.9127 |
64 | 492 | 0.9125 |
65 | 3VQ | 0.9118 |
66 | AZY | 0.9107 |
67 | II4 | 0.9105 |
68 | ZZA | 0.9100 |
69 | 6MW | 0.9098 |
70 | RKV | 0.9097 |
71 | RPN | 0.9095 |
72 | 27K | 0.9090 |
73 | BQ5 | 0.9089 |
74 | 6TZ | 0.9085 |
75 | M3E | 0.9077 |
76 | 2GE | 0.9076 |
77 | TR4 | 0.9076 |
78 | 2GD | 0.9075 |
79 | KCH | 0.9075 |
80 | G14 | 0.9073 |
81 | 36Z | 0.9068 |
82 | IWT | 0.9061 |
83 | LL1 | 0.9043 |
84 | L03 | 0.9042 |
85 | MIL | 0.9041 |
86 | SSY | 0.9040 |
87 | 4G2 | 0.9032 |
88 | 36M | 0.9030 |
89 | BP7 | 0.9027 |
90 | TCR | 0.9025 |
91 | 9XZ | 0.9022 |
92 | WUB | 0.9021 |
93 | EWG | 0.9019 |
94 | 3DE | 0.9018 |
95 | ONR | 0.9018 |
96 | 5NR | 0.9012 |
97 | RA7 | 0.9010 |
98 | SOV | 0.9008 |
99 | JI2 | 0.9003 |
100 | 7O4 | 0.9002 |
101 | KW8 | 0.8998 |
102 | P4L | 0.8998 |
103 | HH6 | 0.8994 |
104 | 5UH | 0.8991 |
105 | 7R4 | 0.8989 |
106 | 0F9 | 0.8987 |
107 | X48 | 0.8980 |
108 | 5P3 | 0.8974 |
109 | GNV | 0.8972 |
110 | PUE | 0.8970 |
111 | RVE | 0.8970 |
112 | EYJ | 0.8969 |
113 | DXK | 0.8967 |
114 | 5E5 | 0.8964 |
115 | EV2 | 0.8964 |
116 | BVS | 0.8962 |
117 | JF5 | 0.8955 |
118 | 6C5 | 0.8954 |
119 | BPY | 0.8949 |
120 | A5H | 0.8947 |
121 | JMG | 0.8945 |
122 | 1ZC | 0.8945 |
123 | 92G | 0.8945 |
124 | D8Q | 0.8945 |
125 | 1SF | 0.8944 |
126 | AJG | 0.8940 |
127 | 4V2 | 0.8939 |
128 | LRW | 0.8932 |
129 | J1K | 0.8931 |
130 | GNY | 0.8931 |
131 | 0UL | 0.8931 |
132 | U4J | 0.8930 |
133 | AQ1 | 0.8929 |
134 | 2D2 | 0.8928 |
135 | GF4 | 0.8925 |
136 | NIR | 0.8924 |
137 | 3CX | 0.8921 |
138 | 4AU | 0.8921 |
139 | 363 | 0.8921 |
140 | GOE | 0.8920 |
141 | MKN | 0.8918 |
142 | 5V5 | 0.8918 |
143 | D25 | 0.8916 |
144 | TT4 | 0.8916 |
145 | 1FE | 0.8912 |
146 | QKU | 0.8912 |
147 | LJ3 | 0.8911 |
148 | F40 | 0.8911 |
149 | 5B2 | 0.8908 |
150 | X11 | 0.8907 |
151 | SNJ | 0.8899 |
152 | CK1 | 0.8898 |
153 | L15 | 0.8896 |
154 | 5V6 | 0.8894 |
155 | JCZ | 0.8893 |
156 | RCV | 0.8891 |
157 | XEV | 0.8890 |
158 | BZM | 0.8884 |
159 | 3D8 | 0.8881 |
160 | EQA | 0.8881 |
161 | GZ2 | 0.8881 |
162 | S7S | 0.8879 |
163 | 6C9 | 0.8879 |
164 | G30 | 0.8879 |
165 | 15Q | 0.8876 |
166 | YTX | 0.8873 |
167 | YZ9 | 0.8871 |
168 | 1A7 | 0.8871 |
169 | 2GQ | 0.8869 |
170 | 7VP | 0.8867 |
171 | 833 | 0.8866 |
172 | ODK | 0.8863 |
173 | 2LW | 0.8863 |
174 | NIF | 0.8859 |
175 | QR2 | 0.8857 |
176 | 1AJ | 0.8854 |
177 | 6DQ | 0.8853 |
178 | 1XS | 0.8849 |
179 | B4O | 0.8848 |
180 | S46 | 0.8847 |
181 | EQW | 0.8843 |
182 | 90G | 0.8841 |
183 | OKM | 0.8840 |
184 | JTA | 0.8840 |
185 | 0OY | 0.8836 |
186 | 9UL | 0.8835 |
187 | 69W | 0.8834 |
188 | BSA | 0.8834 |
189 | ZME | 0.8833 |
190 | 90M | 0.8830 |
191 | HX4 | 0.8830 |
192 | P93 | 0.8828 |
193 | TJM | 0.8828 |
194 | 4XF | 0.8828 |
195 | 5KN | 0.8825 |
196 | FZ0 | 0.8823 |
197 | 8RK | 0.8822 |
198 | 549 | 0.8821 |
199 | P7V | 0.8820 |
200 | CUT | 0.8819 |
201 | M83 | 0.8817 |
202 | EZL | 0.8815 |
203 | P80 | 0.8813 |
204 | CH9 | 0.8810 |
205 | VXX | 0.8810 |
206 | CK2 | 0.8809 |
207 | KYN | 0.8808 |
208 | 3RP | 0.8805 |
209 | 0W1 | 0.8803 |
210 | 9CE | 0.8803 |
211 | JWS | 0.8802 |
212 | M1Z | 0.8800 |
213 | N7I | 0.8798 |
214 | RAY | 0.8796 |
215 | SOJ | 0.8795 |
216 | L98 | 0.8793 |
217 | 1FL | 0.8786 |
218 | HL6 | 0.8784 |
219 | 463 | 0.8781 |
220 | 6C4 | 0.8775 |
221 | D1Y | 0.8774 |
222 | 6C8 | 0.8773 |
223 | 4GU | 0.8772 |
224 | 5TO | 0.8769 |
225 | 0MB | 0.8768 |
226 | 2UD | 0.8767 |
227 | DDC | 0.8767 |
228 | 692 | 0.8765 |
229 | FER | 0.8764 |
230 | IQ5 | 0.8762 |
231 | C82 | 0.8760 |
232 | 6J9 | 0.8756 |
233 | BQ2 | 0.8756 |
234 | PIQ | 0.8755 |
235 | TIA | 0.8754 |
236 | BGU | 0.8753 |
237 | UKV | 0.8751 |
238 | HJH | 0.8751 |
239 | 3XH | 0.8751 |
240 | C4E | 0.8749 |
241 | M5H | 0.8749 |
242 | GJK | 0.8748 |
243 | TXW | 0.8747 |
244 | ET0 | 0.8747 |
245 | Y3L | 0.8744 |
246 | 47V | 0.8743 |
247 | HRM | 0.8741 |
248 | SU9 | 0.8740 |
249 | OJD | 0.8739 |
250 | 7L4 | 0.8739 |
251 | BZQ | 0.8737 |
252 | MS0 | 0.8737 |
253 | AJ1 | 0.8736 |
254 | 0SY | 0.8734 |
255 | TRP | 0.8731 |
256 | 6L6 | 0.8731 |
257 | Q8G | 0.8727 |
258 | 0XR | 0.8727 |
259 | 2J2 | 0.8726 |
260 | DY8 | 0.8720 |
261 | G6Q | 0.8720 |
262 | E9S | 0.8718 |
263 | BNL | 0.8716 |
264 | 3Y7 | 0.8715 |
265 | 4I8 | 0.8711 |
266 | 8NX | 0.8710 |
267 | TU0 | 0.8708 |
268 | 4Z9 | 0.8705 |
269 | K6N | 0.8705 |
270 | DBE | 0.8702 |
271 | JVD | 0.8702 |
272 | 9JT | 0.8700 |
273 | CKA | 0.8697 |
274 | FMQ | 0.8696 |
275 | 27M | 0.8695 |
276 | WLH | 0.8691 |
277 | C0H | 0.8690 |
278 | 2F6 | 0.8689 |
279 | I2E | 0.8689 |
280 | 6FG | 0.8688 |
281 | N4E | 0.8688 |
282 | N3W | 0.8687 |
283 | 9FH | 0.8685 |
284 | AJD | 0.8684 |
285 | KLE | 0.8682 |
286 | 3CA | 0.8682 |
287 | NFZ | 0.8680 |
288 | Q8D | 0.8677 |
289 | A73 | 0.8673 |
290 | AH3 | 0.8672 |
291 | GXD | 0.8671 |
292 | 77X | 0.8670 |
293 | ZRK | 0.8669 |
294 | GUS | 0.8668 |
295 | 3F4 | 0.8667 |
296 | H4E | 0.8666 |
297 | RGK | 0.8664 |
298 | MXD | 0.8664 |
299 | WDW | 0.8657 |
300 | 3VW | 0.8656 |
301 | ENO | 0.8655 |
302 | IOP | 0.8654 |
303 | SZ5 | 0.8653 |
304 | 25F | 0.8651 |
305 | LDC | 0.8646 |
306 | 1AE | 0.8644 |
307 | F1X | 0.8644 |
308 | LLT | 0.8644 |
309 | LR2 | 0.8643 |
310 | 272 | 0.8641 |
311 | 0RY | 0.8640 |
312 | 5GT | 0.8639 |
313 | CIY | 0.8637 |
314 | 7ZL | 0.8637 |
315 | PZX | 0.8635 |
316 | ENG | 0.8634 |
317 | KM2 | 0.8631 |
318 | DFL | 0.8631 |
319 | 3SU | 0.8630 |
320 | BXZ | 0.8627 |
321 | 4F8 | 0.8623 |
322 | WOE | 0.8621 |
323 | MVH | 0.8619 |
324 | AH6 | 0.8617 |
325 | 0FS | 0.8615 |
326 | 3ZB | 0.8612 |
327 | 428 | 0.8611 |
328 | C0W | 0.8611 |
329 | XDE | 0.8608 |
330 | ALE | 0.8608 |
331 | A8K | 0.8605 |
332 | 20D | 0.8604 |
333 | NKI | 0.8603 |
334 | CX4 | 0.8602 |
335 | F6P | 0.8601 |
336 | IPO | 0.8599 |
337 | MD6 | 0.8598 |
338 | 8D6 | 0.8596 |
339 | JGY | 0.8594 |
340 | VGS | 0.8593 |
341 | 7MW | 0.8592 |
342 | FX5 | 0.8592 |
343 | W29 | 0.8590 |
344 | PA5 | 0.8583 |
345 | S0J | 0.8582 |
346 | CUQ | 0.8577 |
347 | ERZ | 0.8570 |
348 | B21 | 0.8567 |
349 | R9G | 0.8566 |
350 | LZ5 | 0.8559 |
351 | GXG | 0.8557 |
352 | KPV | 0.8548 |
353 | VFG | 0.8543 |
354 | DTR | 0.8541 |
355 | JAA | 0.8533 |
356 | P9I | 0.8531 |
357 | JRB | 0.8531 |
358 | ALA ZGL | 0.8525 |
359 | AWE | 0.8525 |