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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 5 families. | |||||
1 | 1CB0 | - | ADE | C5 H5 N5 | c1[nH]c2c(.... |
2 | 1SD2 | - | MTH | C12 H16 N4 O3 S | CSC[C@@H]1.... |
3 | 1CG6 | - | MTA | C11 H15 N5 O3 S | CSC[C@@H]1.... |
4 | 1K27 | Ki = 1 nM | MTM | C12 H19 N5 O2 S | CSC[C@@H]1.... |
5 | 1SD1 | - | FMC | C10 H13 N5 O4 | c1nc2c(c(n.... |
6 | 6DZ0 | Kd = 0.94 nM | OS3 | C17 H23 N5 O S | C#CCCCSC[C.... |
7 | 6DZ3 | Kd = 1.3 nM | OS6 | C21 H32 N8 O S | CCCCn1cc(n.... |
8 | 6DYZ | Kd = 0.63 nM | OS2 | C15 H19 N5 O S | C#CCSC[C@H.... |
9 | 6DZ2 | Kd = 1.4 nM | OS5 | C24 H30 N8 O S | c1ccc(cc1).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 3 families. | |||||
1 | 5FAK | - | ADE | C5 H5 N5 | c1[nH]c2c(.... |
2 | 5F7O | - | ADE | C5 H5 N5 | c1[nH]c2c(.... |
3 | 5F77 | - | ADE | C5 H5 N5 | c1[nH]c2c(.... |
4 | 5F7X | - | TBN | C11 H14 N4 O4 | c1cn(c2c1c.... |
5 | 5F76 | - | MTA | C11 H15 N5 O3 S | CSC[C@@H]1.... |
6 | 5F7J | - | ADE | C5 H5 N5 | c1[nH]c2c(.... |
7 | 3T94 | - | MTA | C11 H15 N5 O3 S | CSC[C@@H]1.... |
8 | 1CB0 | - | ADE | C5 H5 N5 | c1[nH]c2c(.... |
9 | 1SD2 | - | MTH | C12 H16 N4 O3 S | CSC[C@@H]1.... |
10 | 1CG6 | - | MTA | C11 H15 N5 O3 S | CSC[C@@H]1.... |
11 | 1K27 | Ki = 1 nM | MTM | C12 H19 N5 O2 S | CSC[C@@H]1.... |
12 | 1SD1 | - | FMC | C10 H13 N5 O4 | c1nc2c(c(n.... |
13 | 6DZ0 | Kd = 0.94 nM | OS3 | C17 H23 N5 O S | C#CCCCSC[C.... |
14 | 6DZ3 | Kd = 1.3 nM | OS6 | C21 H32 N8 O S | CCCCn1cc(n.... |
15 | 6DYZ | Kd = 0.63 nM | OS2 | C15 H19 N5 O S | C#CCSC[C@H.... |
16 | 6DZ2 | Kd = 1.4 nM | OS5 | C24 H30 N8 O S | c1ccc(cc1).... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | ADN | 1.0000 |
2 | IMH | 0.9968 |
3 | NOS | 0.9965 |
4 | FMB | 0.9956 |
5 | TBN | 0.9937 |
6 | 9DI | 0.9933 |
7 | A | 0.9845 |
8 | 5N5 | 0.9841 |
9 | 1DA | 0.9837 |
10 | GMP | 0.9820 |
11 | XYA | 0.9811 |
12 | ARJ | 0.9809 |
13 | NOC | 0.9809 |
14 | 2FA | 0.9804 |
15 | 5AD | 0.9800 |
16 | TAL | 0.9793 |
17 | MDR | 0.9789 |
18 | A4D | 0.9787 |
19 | MTP | 0.9760 |
20 | MTA | 0.9756 |
21 | MTI | 0.9751 |
22 | PRH | 0.9751 |
23 | UA2 | 0.9740 |
24 | 6CR | 0.9732 |
25 | MTM | 0.9730 |
26 | MTH | 0.9721 |
27 | RAB | 0.9714 |
28 | HPR | 0.9711 |
29 | 5CD | 0.9708 |
30 | 3D1 | 0.9705 |
31 | 5UD | 0.9693 |
32 | 3BH | 0.9688 |
33 | IMG | 0.9681 |
34 | 2FD | 0.9658 |
35 | AD3 | 0.9658 |
36 | 5FD | 0.9658 |
37 | RPP | 0.9636 |
38 | SNI | 0.9633 |
39 | Y3J | 0.9628 |
40 | 3AD | 0.9614 |
41 | 8OX | 0.9612 |
42 | 6MD | 0.9611 |
43 | 5ID | 0.9593 |
44 | GNG | 0.9582 |
45 | DBM | 0.9575 |
46 | PUR | 0.9547 |
47 | NWW | 0.9527 |
48 | CFE | 0.9526 |
49 | EKH | 0.9513 |
50 | 5F1 | 0.9511 |
51 | 4UO | 0.9500 |
52 | 7D7 | 0.9499 |
53 | FTU | 0.9497 |
54 | CL9 | 0.9492 |
55 | THM | 0.9490 |
56 | 26A | 0.9471 |
57 | DNB | 0.9450 |
58 | F01 | 0.9450 |
59 | MG7 | 0.9397 |
60 | 5I5 | 0.9395 |
61 | 0DN | 0.9374 |
62 | URI | 0.9362 |
63 | 5BT | 0.9356 |
64 | 5NB | 0.9353 |
65 | ZAS | 0.9351 |
66 | NWQ | 0.9343 |
67 | RFZ | 0.9337 |
68 | MCF | 0.9329 |
69 | DCF | 0.9327 |
70 | CC5 | 0.9300 |
71 | MZR | 0.9297 |
72 | CTN | 0.9296 |
73 | 5MD | 0.9289 |
74 | NQ7 | 0.9287 |
75 | MCY | 0.9277 |
76 | B86 | 0.9275 |
77 | 9UL | 0.9268 |
78 | RBV | 0.9268 |
79 | 38B | 0.9266 |
80 | N8M | 0.9262 |
81 | H7S | 0.9255 |
82 | TIZ | 0.9251 |
83 | 3DH | 0.9242 |
84 | SCT | 0.9239 |
85 | RVD | 0.9231 |
86 | DUR | 0.9218 |
87 | 13A | 0.9214 |
88 | ID2 | 0.9210 |
89 | AHU | 0.9188 |
90 | NNR | 0.9184 |
91 | I5A | 0.9175 |
92 | 8HG | 0.9172 |
93 | PIR | 0.9158 |
94 | QQY | 0.9144 |
95 | ZYV | 0.9142 |
96 | 3DT | 0.9134 |
97 | UUA | 0.9133 |
98 | 5BX | 0.9128 |
99 | XTS | 0.9126 |
100 | NEO | 0.9116 |
101 | 3L1 | 0.9114 |
102 | KF5 | 0.9107 |
103 | M2T | 0.9100 |
104 | 2TU | 0.9099 |
105 | NEC | 0.9089 |
106 | TO1 | 0.9083 |
107 | QQX | 0.9079 |
108 | GA2 | 0.9078 |
109 | Z8B | 0.9076 |
110 | CMP | 0.9063 |
111 | C1Y | 0.9056 |
112 | TCL | 0.9046 |
113 | TIA | 0.9046 |
114 | THU | 0.9045 |
115 | ACK | 0.9041 |
116 | CDY | 0.9032 |
117 | 5AE | 0.9031 |
118 | ANU | 0.9028 |
119 | DIH | 0.9021 |
120 | LLT | 0.9021 |
121 | HO4 | 0.9019 |
122 | XYP XYS | 0.9018 |
123 | TRP | 0.9012 |
124 | EP4 | 0.9012 |
125 | DCZ | 0.9006 |
126 | JVQ | 0.8998 |
127 | 5P7 | 0.8994 |
128 | TDI | 0.8994 |
129 | 5JT | 0.8993 |
130 | 8DA | 0.8988 |
131 | CTE | 0.8983 |
132 | XYS XYP | 0.8983 |
133 | VCE | 0.8978 |
134 | PE2 | 0.8975 |
135 | DBS | 0.8974 |
136 | X2M | 0.8974 |
137 | A3N | 0.8973 |
138 | ZIQ | 0.8970 |
139 | AFX | 0.8966 |
140 | BVD | 0.8964 |
141 | CTD | 0.8964 |
142 | NEU | 0.8961 |
143 | XYP XYP | 0.8957 |
144 | SY4 | 0.8954 |
145 | RVB | 0.8954 |
146 | Q5M | 0.8952 |
147 | IM5 | 0.8950 |
148 | JA3 | 0.8947 |
149 | EAJ | 0.8945 |
150 | TR7 | 0.8934 |
151 | GEO | 0.8930 |
152 | SGP | 0.8929 |
153 | HBI | 0.8929 |
154 | 92O | 0.8928 |
155 | JMQ | 0.8928 |
156 | ACE TRP | 0.8926 |
157 | B5A | 0.8926 |
158 | 5GV | 0.8924 |
159 | AOJ | 0.8921 |
160 | M83 | 0.8920 |
161 | SRA | 0.8919 |
162 | 6J3 | 0.8918 |
163 | RP1 | 0.8915 |
164 | JF8 | 0.8914 |
165 | AGV | 0.8912 |
166 | XIF XYP | 0.8900 |
167 | NIR | 0.8899 |
168 | KYN | 0.8894 |
169 | Z17 | 0.8893 |
170 | ZJB | 0.8893 |
171 | W29 | 0.8889 |
172 | A4Q | 0.8889 |
173 | 4F0 | 0.8888 |
174 | SGV | 0.8884 |
175 | WCU | 0.8883 |
176 | H4B | 0.8881 |
177 | N5O | 0.8880 |
178 | 88R | 0.8875 |
179 | 0HY | 0.8875 |
180 | URD | 0.8873 |
181 | ABM | 0.8866 |
182 | MPU | 0.8865 |
183 | WV7 | 0.8864 |
184 | AMP | 0.8862 |
185 | IMP | 0.8862 |
186 | 96Z | 0.8858 |
187 | 2L2 | 0.8858 |
188 | 5ER | 0.8857 |
189 | XYS XYS | 0.8855 |
190 | 22L | 0.8849 |
191 | 0GA | 0.8847 |
192 | BNY | 0.8846 |
193 | M77 | 0.8843 |
194 | MEX | 0.8836 |
195 | KP2 | 0.8831 |
196 | AUT | 0.8829 |
197 | TLF | 0.8825 |
198 | MR6 | 0.8824 |
199 | 6SW | 0.8823 |
200 | AR3 | 0.8823 |
201 | 14Z | 0.8822 |
202 | EF2 | 0.8820 |
203 | 1Q4 | 0.8818 |
204 | AC2 | 0.8816 |
205 | 2L1 | 0.8816 |
206 | GPK | 0.8816 |
207 | FWD | 0.8815 |
208 | LTN | 0.8814 |
209 | ITW | 0.8812 |
210 | DDU | 0.8812 |
211 | OVE | 0.8811 |
212 | EAT | 0.8811 |
213 | 0J4 | 0.8810 |
214 | A4N | 0.8809 |
215 | 2J5 | 0.8808 |
216 | 7CI | 0.8805 |
217 | 2DL | 0.8805 |
218 | 78U | 0.8805 |
219 | TH4 | 0.8803 |
220 | ZSP | 0.8800 |
221 | N8Z | 0.8797 |
222 | 0J2 | 0.8794 |
223 | 5SJ | 0.8794 |
224 | WL3 | 0.8786 |
225 | DTE | 0.8785 |
226 | ALN | 0.8785 |
227 | D5M | 0.8784 |
228 | E1N | 0.8783 |
229 | DA | 0.8782 |
230 | 4GU | 0.8781 |
231 | BDJ | 0.8776 |
232 | H2B | 0.8775 |
233 | C0H | 0.8775 |
234 | CUT | 0.8774 |
235 | 2UD | 0.8770 |
236 | XDL XYP | 0.8769 |
237 | TMC | 0.8769 |
238 | 1A5 | 0.8768 |
239 | CWD | 0.8768 |
240 | Z25 | 0.8767 |
241 | XYP XIF | 0.8764 |
242 | 848 | 0.8761 |
243 | 2QU | 0.8760 |
244 | ZEB | 0.8760 |
245 | II4 | 0.8760 |
246 | JO5 | 0.8758 |
247 | EXX | 0.8757 |
248 | NXB | 0.8749 |
249 | 4AB | 0.8749 |
250 | 3VW | 0.8747 |
251 | PF1 | 0.8743 |
252 | WS6 | 0.8743 |
253 | A7K | 0.8741 |
254 | 4OG | 0.8740 |
255 | WG8 | 0.8737 |
256 | EXG | 0.8735 |
257 | G | 0.8731 |
258 | BGC GLC | 0.8731 |
259 | G30 | 0.8730 |
260 | DTR | 0.8730 |
261 | 3Y7 | 0.8728 |
262 | JGB | 0.8728 |
263 | 5GP | 0.8728 |
264 | DKZ | 0.8727 |
265 | 7AP | 0.8723 |
266 | EXR | 0.8723 |
267 | BIO | 0.8723 |
268 | 1ZC | 0.8721 |
269 | DKX | 0.8718 |
270 | M5H | 0.8717 |
271 | FPL | 0.8715 |
272 | A4B | 0.8714 |
273 | DK4 | 0.8712 |
274 | 7ZL | 0.8712 |
275 | 724 | 0.8711 |
276 | 4CN | 0.8711 |
277 | ETV | 0.8710 |
278 | LL1 | 0.8709 |
279 | 7QV | 0.8708 |
280 | FYR | 0.8708 |
281 | XMP | 0.8706 |
282 | 3IP | 0.8705 |
283 | M0N | 0.8704 |
284 | XYP AHR | 0.8704 |
285 | EXL | 0.8703 |
286 | 5V7 | 0.8702 |
287 | X6P | 0.8702 |
288 | 2AM | 0.8702 |
289 | CJB | 0.8701 |
290 | ZEZ | 0.8699 |
291 | 71V | 0.8698 |
292 | 5E5 | 0.8695 |
293 | 51Y | 0.8691 |
294 | C4E | 0.8689 |
295 | 6U5 | 0.8686 |
296 | DG | 0.8685 |
297 | XYP XDN | 0.8683 |
298 | 0SY | 0.8683 |
299 | Z15 | 0.8682 |
300 | DS8 | 0.8681 |
301 | BGC BMA | 0.8677 |
302 | LVY | 0.8674 |
303 | RVC | 0.8674 |
304 | GPQ | 0.8673 |
305 | TI7 | 0.8672 |
306 | CH8 | 0.8670 |
307 | NIY | 0.8670 |
308 | MJ5 | 0.8668 |
309 | W23 | 0.8666 |
310 | AUV | 0.8665 |
311 | 9BF | 0.8665 |
312 | QKU | 0.8664 |
313 | 0QV | 0.8663 |
314 | HUX | 0.8660 |
315 | 885 | 0.8658 |
316 | HHV | 0.8658 |
317 | GPU | 0.8655 |
318 | 7R7 | 0.8647 |
319 | CUH | 0.8646 |
320 | X29 | 0.8639 |
321 | 6EL | 0.8637 |
322 | DGP | 0.8634 |
323 | B1T | 0.8634 |
324 | S0G | 0.8634 |
325 | WVV | 0.8627 |
326 | GDQ GLC | 0.8627 |
327 | 0FR | 0.8627 |
328 | DXK | 0.8627 |
329 | Y70 | 0.8625 |
330 | 833 | 0.8625 |
331 | 9FG | 0.8623 |
332 | 4WF | 0.8621 |
333 | Q0K | 0.8620 |
334 | 581 | 0.8618 |
335 | 3D8 | 0.8618 |
336 | CX6 | 0.8617 |
337 | 1VK | 0.8614 |
338 | PVQ | 0.8611 |
339 | BHS | 0.8608 |
340 | IM4 | 0.8607 |
341 | 2P3 | 0.8606 |
342 | MUK | 0.8604 |
343 | NWD | 0.8601 |
344 | 16Z | 0.8597 |
345 | DAH | 0.8597 |
346 | 9B3 | 0.8596 |
347 | RE4 | 0.8596 |
348 | B52 | 0.8596 |
349 | 56N | 0.8595 |
350 | IMB | 0.8595 |
351 | A6H | 0.8593 |
352 | 9CE | 0.8592 |
353 | BWD | 0.8592 |
354 | RPN | 0.8589 |
355 | I0D | 0.8585 |
356 | 3AK | 0.8585 |
357 | IOS | 0.8585 |
358 | JOB | 0.8582 |
359 | BMA BMA | 0.8581 |
360 | IWD | 0.8576 |
361 | BP6 | 0.8570 |
362 | CMU | 0.8563 |
363 | 8CS | 0.8556 |
364 | X04 | 0.8555 |
365 | H52 | 0.8555 |
366 | 4NR | 0.8552 |
367 | BXZ | 0.8550 |
368 | NI9 | 0.8549 |
369 | M3Q | 0.8546 |
370 | TMP | 0.8545 |
371 | ZEA | 0.8544 |
372 | 3Q0 | 0.8537 |
373 | 9AA | 0.8536 |
374 | NIA | 0.8525 |
375 | PVK | 0.8520 |
This union binding pocket(no: 1) in the query (biounit: 6dyz.bio1) has 58 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 6dyz.bio1) has 58 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 6dyz.bio1) has 58 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |