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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 3 families. | |||||
1 | 3T01 | Ki = 33 uM | PPF | C H3 O5 P | C(=O)(O)P(.... |
2 | 3T02 | - | PAE | C2 H5 O5 P | C(C(=O)O)P.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1EI6 | - | PPF | C H3 O5 P | C(=O)(O)P(.... |
2 | 3T01 | Ki = 33 uM | PPF | C H3 O5 P | C(=O)(O)P(.... |
3 | 3T02 | - | PAE | C2 H5 O5 P | C(C(=O)O)P.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | CP | 1.0000 |
2 | SAT | 0.9977 |
3 | S0H | 0.9939 |
4 | TB6 | 0.9865 |
5 | FCN | 0.9850 |
6 | MPD | 0.9781 |
7 | X1S | 0.9671 |
8 | HV2 | 0.9628 |
9 | TAU | 0.9604 |
10 | CHT | 0.9597 |
11 | 2HE | 0.9588 |
12 | COM | 0.9566 |
13 | PAH | 0.9565 |
14 | 3Q7 | 0.9554 |
15 | MAE | 0.9552 |
16 | POA | 0.9549 |
17 | MLI | 0.9547 |
18 | P7I | 0.9539 |
19 | 8X3 | 0.9535 |
20 | OPE | 0.9529 |
21 | A20 | 0.9526 |
22 | 3PY | 0.9512 |
23 | IVA | 0.9510 |
24 | DMG | 0.9507 |
25 | GG6 | 0.9502 |
26 | BTL | 0.9500 |
27 | FJO | 0.9499 |
28 | 3HR | 0.9498 |
29 | MLA | 0.9496 |
30 | 3HL | 0.9494 |
31 | LLQ | 0.9491 |
32 | PPV | 0.9483 |
33 | VX | 0.9478 |
34 | POP | 0.9472 |
35 | ETM | 0.9455 |
36 | IPU | 0.9438 |
37 | SIN | 0.9432 |
38 | TFS | 0.9431 |
39 | UY7 | 0.9417 |
40 | 1DQ | 0.9415 |
41 | EFS | 0.9405 |
42 | FLA | 0.9402 |
43 | 2PN | 0.9397 |
44 | C5J | 0.9388 |
45 | XPO | 0.9381 |
46 | BAE | 0.9380 |
47 | PIS | 0.9374 |
48 | AAE | 0.9374 |
49 | FMS | 0.9367 |
50 | MLM | 0.9361 |
51 | THE | 0.9360 |
52 | KIV | 0.9360 |
53 | VAL | 0.9356 |
54 | HX2 | 0.9356 |
55 | P2D | 0.9355 |
56 | THR | 0.9350 |
57 | KPL | 0.9350 |
58 | ODV | 0.9350 |
59 | PRO | 0.9346 |
60 | CRN | 0.9343 |
61 | NMG | 0.9335 |
62 | 2MH | 0.9332 |
63 | 4JU | 0.9332 |
64 | 9X6 | 0.9326 |
65 | ALO | 0.9320 |
66 | ASN | 0.9311 |
67 | 2PC | 0.9281 |
68 | DPR | 0.9281 |
69 | LER | 0.9280 |
70 | TFB | 0.9267 |
71 | IQ0 | 0.9263 |
72 | 9SB | 0.9263 |
73 | LMR | 0.9262 |
74 | MLT | 0.9261 |
75 | SSN | 0.9261 |
76 | IHG | 0.9260 |
77 | PAF | 0.9254 |
78 | HDA | 0.9252 |
79 | PRS | 0.9248 |
80 | HYP | 0.9242 |
81 | CEJ | 0.9241 |
82 | MDN | 0.9239 |
83 | AKB | 0.9237 |
84 | T2C | 0.9236 |
85 | HZP | 0.9234 |
86 | 273 | 0.9232 |
87 | LEU | 0.9213 |
88 | ASP | 0.9211 |
89 | 2KT | 0.9203 |
90 | MRY | 0.9201 |
91 | DTL | 0.9200 |
92 | CIZ | 0.9194 |
93 | PYC | 0.9190 |
94 | SMV | 0.9190 |
95 | ITN | 0.9189 |
96 | OXL | 0.9186 |
97 | LDU | 0.9185 |
98 | ABU | 0.9184 |
99 | 1AC | 0.9182 |
100 | FW5 | 0.9177 |
101 | I2M | 0.9175 |
102 | FUM | 0.9174 |
103 | JBN | 0.9170 |
104 | TAY | 0.9169 |
105 | H95 | 0.9165 |
106 | G3P | 0.9165 |
107 | G3H | 0.9165 |
108 | DMV | 0.9161 |
109 | OAA | 0.9161 |
110 | 1Y8 | 0.9160 |
111 | 4MV | 0.9160 |
112 | AC5 | 0.9154 |
113 | DXX | 0.9153 |
114 | PCA | 0.9151 |
115 | C2N | 0.9150 |
116 | UYA | 0.9149 |
117 | G2H | 0.9149 |
118 | 1SP | 0.9144 |
119 | 1GP | 0.9141 |
120 | KG7 | 0.9141 |
121 | 1AB | 0.9139 |
122 | 98J | 0.9136 |
123 | COI | 0.9134 |
124 | JZ5 | 0.9128 |
125 | MZ0 | 0.9126 |
126 | 25T | 0.9121 |
127 | 1DU | 0.9121 |
128 | 285 | 0.9118 |
129 | NCM | 0.9113 |
130 | 284 | 0.9113 |
131 | FOA | 0.9112 |
132 | JAB | 0.9109 |
133 | LEA | 0.9104 |
134 | IOM | 0.9102 |
135 | ILE | 0.9102 |
136 | QFH | 0.9101 |
137 | 1SH | 0.9099 |
138 | TZC | 0.9098 |
139 | HIU | 0.9097 |
140 | TLA | 0.9092 |
141 | DCL | 0.9090 |
142 | 192 | 0.9089 |
143 | PBE | 0.9088 |
144 | WTZ | 0.9086 |
145 | 23W | 0.9086 |
146 | NVI | 0.9085 |
147 | 265 | 0.9082 |
148 | HVQ | 0.9080 |
149 | 282 | 0.9079 |
150 | BP9 | 0.9078 |
151 | SMB | 0.9077 |
152 | 9YL | 0.9075 |
153 | RSF | 0.9075 |
154 | TAR | 0.9075 |
155 | URA | 0.9074 |
156 | HLT | 0.9072 |
157 | SYN | 0.9072 |
158 | 23B | 0.9071 |
159 | 3SL | 0.9071 |
160 | BAL | 0.9070 |
161 | R67 | 0.9068 |
162 | SER | 0.9067 |
163 | DSN | 0.9066 |
164 | 3V4 | 0.9062 |
165 | TP5 | 0.9062 |
166 | XLS | 0.9061 |
167 | HSM | 0.9060 |
168 | HYN | 0.9059 |
169 | A2Q | 0.9058 |
170 | DGY | 0.9057 |
171 | CYH | 0.9057 |
172 | SS2 | 0.9056 |
173 | HPY | 0.9051 |
174 | C21 | 0.9051 |
175 | 2RH | 0.9050 |
176 | TEO | 0.9049 |
177 | PRI | 0.9049 |
178 | 03W | 0.9047 |
179 | HIO | 0.9047 |
180 | CYS | 0.9046 |
181 | MZW | 0.9043 |
182 | A3B | 0.9042 |
183 | 34V | 0.9041 |
184 | RBL | 0.9040 |
185 | PTO | 0.9034 |
186 | FBJ | 0.9025 |
187 | DAS | 0.9024 |
188 | ICF | 0.9024 |
189 | XBT | 0.9023 |
190 | 9X7 | 0.9023 |
191 | GLY ALA | 0.9022 |
192 | SRT | 0.9022 |
193 | APY | 0.9020 |
194 | O7U | 0.9020 |
195 | FPY | 0.9019 |
196 | PLQ | 0.9018 |
197 | 2RA | 0.9016 |
198 | 2AS | 0.9015 |
199 | 2EZ | 0.9013 |
200 | DBB | 0.9008 |
201 | YHO | 0.9006 |
202 | 40E | 0.9006 |
203 | ACH | 0.9005 |
204 | OHG | 0.9005 |
205 | AOA | 0.9003 |
206 | SGL | 0.9003 |
207 | HY3 | 0.9001 |
208 | DUC | 0.9000 |
209 | 1SA | 0.8995 |
210 | V1L | 0.8995 |
211 | HSE | 0.8993 |
212 | ECE | 0.8992 |
213 | QSC | 0.8991 |
214 | 2IM | 0.8990 |
215 | 1DH | 0.8990 |
216 | AMC | 0.8989 |
217 | AHB | 0.8988 |
218 | 24T | 0.8988 |
219 | SVJ | 0.8988 |
220 | IPH | 0.8986 |
221 | MAK | 0.8984 |
222 | VAH | 0.8982 |
223 | J1Z | 0.8981 |
224 | ROR | 0.8979 |
225 | PMB | 0.8979 |
226 | PEP | 0.8978 |
227 | XYL | 0.8978 |
228 | RB5 | 0.8978 |
229 | PYR | 0.8977 |
230 | BU4 | 0.8977 |
231 | SAR | 0.8974 |
232 | XIX | 0.8974 |
233 | 3OH | 0.8973 |
234 | OXD | 0.8973 |
235 | SPV | 0.8972 |
236 | GLU | 0.8971 |
237 | 6PC | 0.8971 |
238 | HQE | 0.8971 |
239 | CXL | 0.8969 |
240 | GZ3 | 0.8967 |
241 | 1MR | 0.8967 |
242 | FPN | 0.8966 |
243 | JYD | 0.8965 |
244 | RP7 | 0.8963 |
245 | TNE | 0.8962 |
246 | H3M | 0.8962 |
247 | GOL | 0.8961 |
248 | L60 | 0.8960 |
249 | HUI | 0.8957 |
250 | NCA | 0.8953 |
251 | 60P | 0.8953 |
252 | YCP | 0.8952 |
253 | BUQ | 0.8952 |
254 | HSW | 0.8950 |
255 | BVC | 0.8949 |
256 | HAI | 0.8949 |
257 | NBE | 0.8949 |
258 | 0V5 | 0.8949 |
259 | PYJ | 0.8948 |
260 | OXM | 0.8946 |
261 | ABA | 0.8946 |
262 | PCR | 0.8946 |
263 | 39J | 0.8946 |
264 | RCO | 0.8944 |
265 | ZBT | 0.8943 |
266 | TZL | 0.8943 |
267 | AC0 | 0.8942 |
268 | BEN | 0.8942 |
269 | ICC | 0.8942 |
270 | DCY | 0.8941 |
271 | 1DV | 0.8941 |
272 | DE2 | 0.8940 |
273 | E60 | 0.8938 |
274 | HBX | 0.8936 |
275 | XUL | 0.8936 |
276 | BVG | 0.8936 |
277 | MRZ | 0.8935 |
278 | IMR | 0.8932 |
279 | NXA | 0.8929 |
280 | 5AC | 0.8929 |
281 | DA1 | 0.8929 |
282 | RIP | 0.8927 |
283 | ABN | 0.8922 |
284 | R1X | 0.8922 |
285 | NIO | 0.8916 |
286 | M6W | 0.8914 |
287 | MBN | 0.8914 |
288 | PY7 | 0.8912 |
289 | FPI | 0.8911 |
290 | BUA | 0.8910 |
291 | M58 | 0.8910 |
292 | PZA | 0.8910 |
293 | GUA | 0.8909 |
294 | DAB | 0.8907 |
295 | CRS | 0.8907 |
296 | 3CH | 0.8906 |
297 | ETF | 0.8904 |
298 | PXY | 0.8904 |
299 | 40O | 0.8904 |
300 | ICN | 0.8904 |
301 | DTU | 0.8903 |
302 | CMS | 0.8900 |
303 | LG4 | 0.8900 |
304 | URQ | 0.8898 |
305 | 7EX | 0.8893 |
306 | BAM | 0.8892 |
307 | 69O | 0.8891 |
308 | EDG | 0.8891 |
309 | LAC | 0.8889 |
310 | JZ7 | 0.8888 |
311 | 4AP | 0.8888 |
312 | HRZ | 0.8887 |
313 | 54D | 0.8887 |
314 | HVK | 0.8883 |
315 | 25R | 0.8883 |
316 | GAG | 0.8882 |
317 | EHM | 0.8881 |
318 | 9PO | 0.8880 |
319 | RUU | 0.8878 |
320 | IFM | 0.8876 |
321 | 2AP | 0.8870 |
322 | 3AP | 0.8869 |
323 | BEZ | 0.8869 |
324 | 13P | 0.8869 |
325 | 1CO | 0.8866 |
326 | HCS | 0.8865 |
327 | NTN | 0.8865 |
328 | 278 | 0.8863 |
329 | MUC | 0.8862 |
330 | VGL | 0.8861 |
331 | LG3 | 0.8861 |
332 | RIB | 0.8861 |
333 | WOT | 0.8859 |
334 | EGD | 0.8858 |
335 | 280 | 0.8858 |
336 | SS1 | 0.8857 |
337 | 3BB | 0.8856 |
338 | GBD | 0.8855 |
339 | BVF | 0.8855 |
340 | 9CL | 0.8854 |
341 | GXE | 0.8853 |
342 | 4CH | 0.8853 |
343 | CYT | 0.8850 |
344 | MSF | 0.8850 |
345 | BZF | 0.8847 |
346 | NVA | 0.8845 |
347 | TMZ | 0.8845 |
348 | MEV | 0.8844 |
349 | 0MK | 0.8842 |
350 | PYF | 0.8836 |
351 | BMD | 0.8834 |
352 | FSG | 0.8834 |
353 | MPI | 0.8833 |
354 | DSS | 0.8832 |
355 | 8GF | 0.8831 |
356 | HGY | 0.8830 |
357 | LGA | 0.8830 |
358 | LG5 | 0.8828 |
359 | BML | 0.8828 |
360 | IZC | 0.8827 |
361 | AHR | 0.8826 |
362 | 93B | 0.8825 |
363 | B24 | 0.8824 |
364 | IND | 0.8822 |
365 | FB2 | 0.8821 |
366 | 26D | 0.8820 |
367 | UGC | 0.8820 |
368 | FEH | 0.8819 |
369 | HBA | 0.8818 |
370 | 0R1 | 0.8816 |
371 | 4HS | 0.8813 |
372 | AKG | 0.8811 |
373 | BUB | 0.8810 |
374 | IDH | 0.8810 |
375 | BZI | 0.8808 |
376 | ALA | 0.8808 |
377 | DS0 | 0.8807 |
378 | 2CO | 0.8807 |
379 | OXQ | 0.8805 |
380 | GVH | 0.8801 |
381 | DPF | 0.8801 |
382 | XAP | 0.8799 |
383 | HGQ | 0.8799 |
384 | PEQ | 0.8799 |
385 | MTG | 0.8797 |
386 | JZ9 | 0.8796 |
387 | PUT | 0.8793 |
388 | Z6J | 0.8793 |
389 | TMT | 0.8788 |
390 | CSS | 0.8788 |
391 | IDM | 0.8786 |
392 | SLP | 0.8786 |
393 | BXO | 0.8785 |
394 | LZ1 | 0.8780 |
395 | 2OP | 0.8778 |
396 | 4XX | 0.8778 |
397 | SPA | 0.8778 |
398 | DEN | 0.8778 |
399 | GLN | 0.8775 |
400 | ABE | 0.8774 |
401 | XYS | 0.8771 |
402 | RNS | 0.8771 |
403 | ISZ | 0.8771 |
404 | MXN | 0.8770 |
405 | 8CL | 0.8768 |
406 | BNS | 0.8768 |
407 | 4JN | 0.8767 |
408 | 1CB | 0.8766 |
409 | 7WG | 0.8761 |
410 | TMH | 0.8760 |
411 | DFU | 0.8760 |
412 | 1MC | 0.8756 |
413 | DAL | 0.8755 |
414 | URP | 0.8754 |
415 | NAK | 0.8753 |
416 | FUB | 0.8750 |
417 | ITU | 0.8743 |
418 | NBZ | 0.8742 |
419 | OXZ | 0.8742 |
420 | PYM | 0.8740 |
421 | ETX | 0.8735 |
422 | 7N0 | 0.8726 |
423 | 3U4 | 0.8725 |
424 | 4H2 | 0.8725 |
425 | ARB | 0.8725 |
426 | ORN | 0.8725 |
427 | 0CT | 0.8718 |
428 | XYP | 0.8717 |
429 | FQI | 0.8716 |
430 | B3R | 0.8713 |
431 | BAQ | 0.8713 |
432 | SNE | 0.8712 |
433 | CNH | 0.8711 |
434 | SEJ | 0.8710 |
435 | ALQ | 0.8704 |
436 | CAQ | 0.8700 |
437 | HBR | 0.8698 |
438 | ATQ | 0.8698 |
439 | SKG | 0.8696 |
440 | VSO | 0.8696 |
441 | 3GR | 0.8694 |
442 | 51F | 0.8692 |
443 | URF | 0.8691 |
444 | R8A | 0.8688 |
445 | PBC | 0.8688 |
446 | JZ3 | 0.8685 |
447 | MTD | 0.8685 |
448 | HBS | 0.8684 |
449 | HEW | 0.8684 |
450 | M3T | 0.8684 |
451 | PE9 | 0.8683 |
452 | 4VP | 0.8681 |
453 | 3DY | 0.8680 |
454 | 4DX | 0.8679 |
455 | FBA | 0.8679 |
456 | GLL | 0.8679 |
457 | RSO | 0.8678 |
458 | WBU | 0.8677 |
459 | UNU | 0.8669 |
460 | 6HQ | 0.8668 |
461 | MB3 | 0.8667 |
462 | MCT | 0.8666 |
463 | 3ZQ | 0.8666 |
464 | TDR | 0.8664 |
465 | 3SK | 0.8664 |
466 | FUC | 0.8663 |
467 | FUF | 0.8662 |
468 | LNO | 0.8662 |
469 | FUL | 0.8661 |
470 | AZF | 0.8661 |
471 | CIG | 0.8661 |
472 | 1PT | 0.8660 |
473 | 4JL | 0.8659 |
474 | TZE | 0.8659 |
475 | C2A | 0.8658 |
476 | SAL | 0.8655 |
477 | GBL | 0.8655 |
478 | BEW | 0.8654 |
479 | IOL | 0.8651 |
480 | BE2 | 0.8650 |
481 | 14J | 0.8647 |
482 | PAV | 0.8641 |
483 | MEU | 0.8641 |
484 | BHO | 0.8641 |
485 | NIS | 0.8635 |
486 | MMQ | 0.8627 |
487 | TAN | 0.8621 |
488 | FAC | 0.8620 |
489 | ISU | 0.8611 |
490 | K6H | 0.8602 |
491 | 4SD | 0.8601 |
492 | 8FH | 0.8589 |
493 | RHU | 0.8583 |
494 | OK7 | 0.8582 |
495 | HSL | 0.8581 |
496 | 1DJ | 0.8580 |
497 | XRG | 0.8579 |
498 | 7A8 | 0.8571 |
499 | H76 | 0.8571 |
500 | BUO | 0.8557 |
501 | KSW | 0.8551 |
502 | TB0 | 0.8533 |
503 | TF4 | 0.8526 |
504 | PKU | 0.8517 |
This union binding pocket(no: 1) in the query (biounit: 3t01.bio1) has 11 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |