Receptor
PDB id Resolution Class Description Source Keywords
4gw2 2.16 Å EC: 2.7.3.3 CRYSTAL STRUCTURE OF ARGININE KINASE IN COMPLEX WITH L-ORNIT MGADP, AND NITRATE. LIMULUS POLYPHEMUS ARGININE KINASE PHOSPHAGEN KINASE TRANSFERASE TRANSITION ANALOG KINASE
Ref.: CRYSTAL STRUCTURES OF ARGININE KINASE IN COMPLEX WI NITRATE, AND VARIOUS PHOSPHAGEN ANALOGS. BIOCHEM.BIOPHYS.RES.COMMUN. V. 427 212 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP A:401;
 Valid;
 none;
 submit data
427.201 C10 H15 N5 O10 P2 c1nc(...
MG A:402;
 Invalid;
 none;
 submit data
24.305 Mg [Mg+2...
NO3 A:404;
 Invalid;
 none;
 submit data
62.005 N O3 [N+](...
ORN A:403;
 Valid;
 none;
 submit data
132.161 C5 H12 N2 O2 C(C[C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1M15 1.2 Å EC: 2.7.3.3 TRANSITION STATE STRUCTURE OF ARGININE KINASE LIMULUS POLYPHEMUS ARGININE KINASE CREATINE KINASE PHOSPHAGEN KINASE TRANSITANALOG ADENOSINE TRIPHOSPHATE TRANSFERASE
Ref.: REFINEMENT OF THE ARGININE KINASE TRANSITION-STATE COMPLEX AT 1.2 A RESOLUTION: MECHANISTIC INSIGHTS. ACTA CRYSTALLOGR.,SECT.D V. 58 2009 2002
Members (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 1BG0 - DAR C6 H15 N4 O2 C(C[C@H](C....
2 1M15 - ARG C6 H15 N4 O2 C(C[C@@H](....
3 5J99 - ARG C6 H15 N4 O2 C(C[C@@H](....
4 1P52 - DAR C6 H15 N4 O2 C(C[C@H](C....
5 1RL9 - IOM C4 H11 N3 O2 CN(CC(=O)O....
6 4GW2 - ORN C5 H12 N2 O2 C(C[C@@H](....
7 1SD0 - ARG C6 H15 N4 O2 C(C[C@@H](....
8 4GW0 - ILO C7 H15 N3 O2 CC(=N)NCCC....
9 5J9A - ARG C6 H15 N4 O2 C(C[C@@H](....
10 4GVY - CIR C6 H13 N3 O3 C(C[C@@H](....
70% Homology Family (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4BHL - ARG C6 H15 N4 O2 C(C[C@@H](....
2 1BG0 - DAR C6 H15 N4 O2 C(C[C@H](C....
3 1M15 - ARG C6 H15 N4 O2 C(C[C@@H](....
4 5J99 - ARG C6 H15 N4 O2 C(C[C@@H](....
5 1P52 - DAR C6 H15 N4 O2 C(C[C@H](C....
6 1RL9 - IOM C4 H11 N3 O2 CN(CC(=O)O....
7 4GW2 - ORN C5 H12 N2 O2 C(C[C@@H](....
8 1SD0 - ARG C6 H15 N4 O2 C(C[C@@H](....
9 4GW0 - ILO C7 H15 N3 O2 CC(=N)NCCC....
10 5J9A - ARG C6 H15 N4 O2 C(C[C@@H](....
11 4GVY - CIR C6 H13 N3 O3 C(C[C@@H](....
50% Homology Family (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3JQ3 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
2 1VRP - IOM C4 H11 N3 O2 CN(CC(=O)O....
3 3B6R - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
4 3DRB - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
5 4BHL - ARG C6 H15 N4 O2 C(C[C@@H](....
6 1U6R - IOM C4 H11 N3 O2 CN(CC(=O)O....
7 1BG0 - DAR C6 H15 N4 O2 C(C[C@H](C....
8 1M15 - ARG C6 H15 N4 O2 C(C[C@@H](....
9 5J99 - ARG C6 H15 N4 O2 C(C[C@@H](....
10 1P52 - DAR C6 H15 N4 O2 C(C[C@H](C....
11 1RL9 - IOM C4 H11 N3 O2 CN(CC(=O)O....
12 4GW2 - ORN C5 H12 N2 O2 C(C[C@@H](....
13 1SD0 - ARG C6 H15 N4 O2 C(C[C@@H](....
14 4GW0 - ILO C7 H15 N3 O2 CC(=N)NCCC....
15 5J9A - ARG C6 H15 N4 O2 C(C[C@@H](....
16 4GVY - CIR C6 H13 N3 O3 C(C[C@@H](....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ADP; Similar ligands found: 520
No: Ligand ECFP6 Tc MDL keys Tc
1 ADP 1 1
2 ATP 0.9 1
3 HEJ 0.9 1
4 A2D 0.895522 0.971831
5 AQP 0.887324 1
6 5FA 0.887324 1
7 B4P 0.884058 0.971831
8 AP5 0.884058 0.971831
9 BA3 0.869565 0.971831
10 AN2 0.84507 0.985915
11 AT4 0.84507 0.958904
12 M33 0.833333 0.958333
13 ACQ 0.826667 0.972222
14 A 0.823529 0.971429
15 AMP 0.823529 0.971429
16 ACP 0.821918 0.972222
17 6YZ 0.818182 0.972222
18 APR 0.810811 0.971831
19 AR6 0.810811 0.971831
20 ANP 0.802632 0.972222
21 AD9 0.8 0.972222
22 AGS 0.8 0.945946
23 AMP MG 0.785714 0.929577
24 CA0 0.783784 0.945205
25 ADX 0.783784 0.873418
26 TAT 0.779221 0.958904
27 T99 0.779221 0.958904
28 50T 0.773333 0.958333
29 KG4 0.773333 0.945205
30 45A 0.763889 0.917808
31 ABM 0.763889 0.917808
32 APC 0.763158 0.958904
33 PRX 0.763158 0.893333
34 HQG 0.7625 0.985915
35 ATF 0.759494 0.958904
36 A22 0.753086 0.985915
37 ADP BEF 0.746667 0.943662
38 ADP MG 0.746667 0.943662
39 A12 0.743243 0.958904
40 AP2 0.743243 0.958904
41 SRA 0.736111 0.918919
42 ADQ 0.73494 0.945205
43 25L 0.732558 0.985915
44 5AL 0.725 0.931507
45 8LE 0.725 0.894737
46 2A5 0.717949 0.918919
47 A1R 0.714286 0.907895
48 AU1 0.714286 0.972222
49 A3R 0.714286 0.907895
50 APC MG 0.708861 0.917808
51 ATR 0.708861 0.971429
52 PAP 0.708861 0.985714
53 ATP MG 0.708861 0.943662
54 ADP PO3 0.708861 0.943662
55 8LH 0.707317 0.906667
56 SRP 0.707317 0.906667
57 7D3 0.706667 0.905405
58 JNT 0.705882 0.945205
59 OZV 0.702381 0.971831
60 25A 0.702381 0.971831
61 BEF ADP 0.7 0.917808
62 OAD 0.697674 0.945205
63 9X8 0.697674 0.92
64 8LQ 0.690476 0.906667
65 QA7 0.690476 0.894737
66 RBY 0.6875 0.932432
67 ADV 0.6875 0.932432
68 00A 0.686047 0.883117
69 5SV 0.682353 0.848101
70 OOB 0.682353 0.931507
71 8QN 0.682353 0.931507
72 3OD 0.681818 0.945205
73 BIS 0.681818 0.933333
74 ANP MG 0.674699 0.931507
75 VO4 ADP 0.674699 0.945205
76 ALF ADP 0.674699 0.87013
77 AMO 0.674419 0.932432
78 4AD 0.674419 0.92
79 PAJ 0.674419 0.884615
80 GAP 0.670732 0.893333
81 MAP 0.670588 0.945946
82 DLL 0.666667 0.931507
83 AHX 0.666667 0.896104
84 PTJ 0.662921 0.896104
85 V2G 0.662651 0.896104
86 KMQ 0.659341 0.932432
87 3UK 0.659091 0.918919
88 SON 0.658228 0.932432
89 LMS 0.653333 0.82716
90 B5V 0.651685 0.906667
91 WAQ 0.651685 0.883117
92 LAD 0.651685 0.860759
93 PR8 0.651685 0.85
94 7D4 0.65 0.905405
95 ITT 0.65 0.943662
96 G5P 0.648936 0.921053
97 RAB 0.647059 0.84507
98 XYA 0.647059 0.84507
99 ADN 0.647059 0.84507
100 ME8 0.644444 0.839506
101 TXA 0.644444 0.932432
102 NB8 0.644444 0.896104
103 FYA 0.644444 0.905405
104 1ZZ 0.644444 0.839506
105 6AD 0.642857 0.909091
106 ADP BMA 0.640449 0.918919
107 G3A 0.638298 0.921053
108 DAL AMP 0.632184 0.905405
109 AFH 0.631579 0.884615
110 9SN 0.630435 0.871795
111 9ZA 0.625 0.907895
112 DQV 0.625 0.958333
113 GTA 0.625 0.886076
114 9ZD 0.625 0.907895
115 FA5 0.623656 0.906667
116 B5M 0.623656 0.894737
117 B5Y 0.623656 0.894737
118 UP5 0.622449 0.92
119 CUU 0.621951 0.971831
120 NO7 0.62069 0.932432
121 JSQ 0.619048 0.945946
122 HFD 0.619048 0.945946
123 XAH 0.617021 0.839506
124 AV2 0.616279 0.917808
125 AOC 0.615385 0.821918
126 48N 0.612245 0.896104
127 4UV 0.610526 0.894737
128 NAX 0.606061 0.873418
129 DND 0.606061 0.932432
130 TXD 0.606061 0.907895
131 NAI 0.606061 0.907895
132 6V0 0.606061 0.896104
133 5N5 0.605634 0.819444
134 5AS 0.604938 0.77907
135 A4P 0.60396 0.843373
136 DAT 0.60241 0.905405
137 A2R 0.602273 0.985915
138 OMR 0.6 0.851852
139 TXE 0.6 0.907895
140 GA7 0.597938 0.906667
141 4UU 0.597938 0.894737
142 5CD 0.597222 0.805556
143 A4D 0.597222 0.819444
144 L3W 0.594059 0.932432
145 AP0 0.594059 0.896104
146 4TC 0.594059 0.896104
147 A3P 0.592593 0.971429
148 T5A 0.592233 0.841463
149 139 0.592233 0.873418
150 7D5 0.592105 0.878378
151 ATP A A A 0.589474 0.930556
152 ATP A 0.589474 0.930556
153 LAQ 0.585859 0.839506
154 MYR AMP 0.585106 0.817073
155 H1Q 0.583333 0.90411
156 F2R 0.580952 0.864198
157 YLP 0.58 0.819277
158 UPA 0.578431 0.907895
159 7DD 0.578313 0.985714
160 3AM 0.576923 0.929577
161 ADJ 0.576923 0.851852
162 NAD 0.575472 0.931507
163 COD 0.575472 0.811765
164 3AT 0.574713 0.971831
165 JB6 0.574468 0.883117
166 4UW 0.574257 0.860759
167 EP4 0.573333 0.753247
168 A2P 0.573171 0.957143
169 CNA 0.571429 0.932432
170 TYM 0.568627 0.906667
171 PPS 0.568182 0.873418
172 DTA 0.565789 0.786667
173 M2T 0.565789 0.734177
174 AR6 AR6 0.565657 0.917808
175 80F 0.564815 0.841463
176 A3D 0.564815 0.918919
177 3DH 0.564103 0.773333
178 G5A 0.563218 0.77907
179 YLB 0.563107 0.819277
180 YLC 0.563107 0.839506
181 AMP DBH 0.561224 0.893333
182 MTA 0.558442 0.773333
183 DTP 0.556818 0.905405
184 AHZ 0.554455 0.817073
185 NA7 0.553191 0.958904
186 IOT 0.552381 0.831325
187 ARG AMP 0.55 0.829268
188 ZAS 0.55 0.766234
189 7MD 0.55 0.8625
190 IMO 0.548781 0.929577
191 YLA 0.54717 0.819277
192 NAE 0.544643 0.894737
193 TAD 0.544554 0.884615
194 A5A 0.544444 0.807229
195 2AM 0.544304 0.943662
196 TSB 0.543478 0.819277
197 6RE 0.54321 0.759494
198 6MZ 0.542169 0.930556
199 AYB 0.542056 0.809524
200 NAQ 0.539823 0.871795
201 V3L 0.539326 0.971831
202 AF3 ADP 3PG 0.538462 0.8375
203 ALF ADP 3PG 0.538462 0.8375
204 SSA 0.538462 0.8
205 ZID 0.535088 0.918919
206 LPA AMP 0.533981 0.817073
207 NAD IBO 0.533333 0.917808
208 NAD TDB 0.533333 0.917808
209 VMS 0.532609 0.788235
210 54H 0.532609 0.788235
211 52H 0.532609 0.77907
212 BTX 0.53211 0.841463
213 A3N 0.53012 0.786667
214 J7C 0.53012 0.769231
215 5X8 0.528736 0.763158
216 BT5 0.527273 0.831325
217 53H 0.526882 0.77907
218 8X1 0.526882 0.752809
219 5CA 0.526882 0.8
220 ARU 0.526316 0.860759
221 EAD 0.525862 0.873418
222 RGT 0.525253 0.958904
223 OVE 0.52439 0.905405
224 S4M 0.52381 0.666667
225 7DT 0.522727 0.985714
226 DDS 0.522222 0.878378
227 GDP 0.522222 0.92
228 38V 0.521739 0.886076
229 AVV 0.521277 0.896104
230 NDE 0.521008 0.932432
231 LEU LMS 0.520833 0.730337
232 7MC 0.518868 0.841463
233 DSH 0.518072 0.725
234 MAO 0.517647 0.759036
235 LSS 0.515789 0.761364
236 DSZ 0.515789 0.8
237 NSS 0.515789 0.8
238 P5A 0.515464 0.744444
239 DZD 0.513514 0.884615
240 NWW 0.513158 0.760563
241 O02 0.511111 0.921053
242 NVA LMS 0.510417 0.752809
243 9K8 0.510204 0.714286
244 12D 0.509615 0.785714
245 YLY 0.508772 0.809524
246 M24 0.508772 0.85
247 P1H 0.508333 0.851852
248 5AD 0.506849 0.746479
249 GJV 0.505882 0.75
250 AMP NAD 0.504505 0.905405
251 4TA 0.504505 0.807229
252 NAJ PZO 0.504425 0.848101
253 D4F 0.504348 0.839506
254 KAA 0.5 0.752809
255 GSU 0.5 0.77907
256 71V 0.5 0.907895
257 7D7 0.5 0.743243
258 A3G 0.5 0.8
259 128 0.5 0.776471
260 NDC 0.5 0.871795
261 N0B 0.495726 0.819277
262 NJP 0.495495 0.945946
263 ODP 0.495495 0.909091
264 K3K 0.49505 0.802632
265 2SA 0.494624 0.932432
266 6C6 0.494505 0.881579
267 SFG 0.494382 0.75
268 0WD 0.491071 0.921053
269 LQJ 0.490196 0.917808
270 B1U 0.490196 0.736264
271 YSA 0.490196 0.77907
272 PO4 PO4 A A A A PO4 0.489796 0.902778
273 SAM 0.48913 0.690476
274 6IA 0.48913 0.8375
275 A7D 0.488636 0.776316
276 6FA 0.488 0.841463
277 FB0 0.487805 0.804598
278 NAJ PYZ 0.487179 0.807229
279 J4G 0.484848 0.92
280 A5D 0.483516 0.786667
281 IDP 0.483516 0.918919
282 SA8 0.483516 0.707317
283 PGS 0.483146 0.883117
284 MHZ 0.483146 0.697674
285 DA 0.482353 0.878378
286 NEC 0.482353 0.746667
287 D5M 0.482353 0.878378
288 NIA 0.481928 0.822785
289 Y3J 0.480519 0.726027
290 8PZ 0.480392 0.8
291 FAD 0.480315 0.851852
292 FAS 0.480315 0.851852
293 FDA 0.48 0.833333
294 N6P 0.479592 0.915493
295 GGZ 0.479167 0.825
296 SAI 0.478261 0.734177
297 SAH 0.478261 0.74359
298 NPW 0.477477 0.886076
299 NDP 0.477477 0.921053
300 AAM 0.476744 0.971429
301 AMZ 0.47561 0.916667
302 C2R 0.47561 0.90411
303 SMM 0.473684 0.686047
304 GTP 0.473684 0.92
305 NZQ 0.473214 0.909091
306 TXP 0.473214 0.921053
307 A3S 0.47191 0.810811
308 K3E 0.471154 0.792208
309 NWQ 0.46988 0.739726
310 SFD 0.46875 0.734043
311 AIR 0.468354 0.901408
312 AAT 0.468085 0.707317
313 EEM 0.468085 0.690476
314 7C5 0.466667 0.818182
315 Z5A 0.466667 0.77907
316 J7V 0.466667 0.833333
317 62F 0.465649 0.8625
318 N5O 0.465116 0.763158
319 HDV 0.463158 0.893333
320 KOY 0.462963 0.802632
321 FAY 0.462121 0.8625
322 DCA 0.461538 0.823529
323 A3T 0.461538 0.821918
324 ETB 0.461538 0.833333
325 A6D 0.46 0.722892
326 6K6 0.459184 0.930556
327 QXP 0.459184 0.785714
328 GEK 0.459184 0.7375
329 RFL 0.458647 0.821429
330 S7M 0.458333 0.690476
331 V47 0.458333 0.783784
332 NAP 0.458333 0.945205
333 4YB 0.457944 0.761364
334 CZF 0.457447 0.931507
335 TAP 0.454545 0.907895
336 N5A 0.454545 0.736842
337 FNK 0.454545 0.804598
338 WSA 0.454545 0.788235
339 COA 0.453782 0.823529
340 0T1 0.453782 0.823529
341 101 0.453488 0.878378
342 QBQ 0.452632 0.906667
343 DZ4 0.452632 0.881579
344 XNP 0.452174 0.873418
345 K2R 0.45098 0.88
346 NA0 0.45082 0.932432
347 7RP 0.448276 0.928571
348 K2W 0.447619 0.740741
349 GP3 0.446809 0.921053
350 TM1 0.446602 0.77381
351 APU 0.446429 0.894737
352 KL2 0.445783 0.837838
353 QXG 0.445545 0.776471
354 PUA 0.445378 0.884615
355 V1N 0.443396 0.917808
356 7RA 0.443182 0.957747
357 CAO 0.442623 0.795455
358 30N 0.442623 0.752688
359 COS 0.442623 0.804598
360 AMX 0.442623 0.833333
361 K38 0.442308 0.779221
362 QQY 0.44186 0.815789
363 ACK 0.44186 0.861111
364 649 0.441441 0.744444
365 R2V 0.441176 0.785714
366 0UM 0.44 0.698795
367 NHD 0.439655 0.905405
368 SCO 0.439024 0.823529
369 CMX 0.439024 0.823529
370 GCP 0.438776 0.896104
371 8BR 0.438202 0.906667
372 GNH 0.4375 0.907895
373 3AD 0.4375 0.805556
374 8Q2 0.4375 0.772727
375 O05 0.436893 0.843373
376 NVA 2AD 0.43617 0.759494
377 62X 0.435644 0.666667
378 K2H 0.435644 0.75641
379 ACO 0.435484 0.795455
380 FAM 0.435484 0.804598
381 FCX 0.435484 0.795455
382 9JJ 0.434783 0.8625
383 KY2 0.434343 0.731707
384 9GM 0.434343 0.896104
385 GNP 0.434343 0.896104
386 K3H 0.433962 0.75
387 NMX 0.433071 0.76087
388 MGP 0.43299 0.884615
389 26A 0.432099 0.763158
390 HAX 0.432 0.804598
391 K15 0.431373 0.682353
392 9BG 0.431034 0.896104
393 DG1 0.430894 0.921053
394 1DG 0.430894 0.921053
395 QQX 0.430233 0.805195
396 2VA 0.430108 0.8
397 S8M 0.43 0.759494
398 2MC 0.429688 0.769231
399 PLP AAD 0.428571 0.733333
400 6G0 0.428571 0.884615
401 3KK 0.428571 0.804598
402 P5F 0.428571 0.823529
403 NAD BBN 0.428571 0.841463
404 FYN 0.428571 0.823529
405 KGA 0.427481 0.744681
406 7L1 0.427419 0.795455
407 K2K 0.427184 0.7375
408 NX8 0.427083 0.716049
409 RMB 0.426966 0.873239
410 AS 0.426966 0.833333
411 FAI 0.426966 0.916667
412 KGJ 0.426357 0.752688
413 KYB 0.425743 0.731707
414 1RB 0.425287 0.885714
415 KGP 0.425197 0.729167
416 OXK 0.425197 0.804598
417 COK 0.425197 0.804598
418 SOP 0.425197 0.804598
419 MCD 0.425197 0.804598
420 CA6 0.425197 0.729167
421 YZS 0.425197 0.729167
422 G1R 0.424242 0.907895
423 CC5 0.423077 0.816901
424 SXZ 0.423077 0.710843
425 F2N 0.422535 0.813953
426 NAD CJ3 0.422222 0.811765
427 EO7 0.422222 0.788235
428 ANZ 0.422018 0.8
429 CMC 0.421875 0.804598
430 CO6 0.421875 0.804598
431 1VU 0.421875 0.795455
432 ZDA 0.421053 0.864865
433 GKE 0.420561 0.884615
434 GDC 0.420561 0.884615
435 GDD 0.420561 0.884615
436 NFD 0.420168 0.883117
437 GSP 0.42 0.873418
438 D3Y 0.42 0.789474
439 MC4 0.419847 0.76087
440 3D1 0.419753 0.773333
441 3L1 0.419753 0.773333
442 FA9 0.41958 0.864198
443 G 0.419355 0.906667
444 5GP 0.419355 0.906667
445 KB1 0.419048 0.698795
446 KY5 0.419048 0.725
447 SCD 0.418605 0.823529
448 CAJ 0.418605 0.804598
449 2BA 0.417582 0.915493
450 CMP 0.417582 0.901408
451 SO8 0.416667 0.789474
452 VRT 0.416667 0.769231
453 KFV 0.416667 0.736842
454 N01 0.416667 0.905405
455 1HE 0.415385 0.786517
456 3HC 0.415385 0.813953
457 BCO 0.415385 0.804598
458 MLC 0.415385 0.804598
459 IVC 0.415385 0.813953
460 A1S 0.415385 0.804598
461 NMN AMP PO4 0.415254 0.87013
462 2FA 0.414634 0.813333
463 MGO 0.414141 0.860759
464 FAJ 0.413793 0.831325
465 3NZ 0.413462 0.782051
466 KY8 0.413462 0.728395
467 Q34 0.412281 0.674419
468 LCV 0.412214 0.721649
469 COO 0.412214 0.804598
470 MCA 0.412214 0.795455
471 CAA 0.412214 0.813953
472 SO5 0.412214 0.721649
473 YE1 0.412214 0.813953
474 GAV 0.411765 0.884615
475 PRT 0.411215 0.931507
476 JLN 0.411111 0.890411
477 P2P 0.411111 0.902778
478 OZP 0.410714 0.728395
479 NWZ 0.410526 0.703704
480 ZZB 0.410256 0.77381
481 CNV FAD 0.410072 0.793103
482 YXR 0.409091 0.729167
483 2CP 0.409091 0.795455
484 YXS 0.409091 0.729167
485 SCA 0.409091 0.804598
486 SP1 0.409091 0.842105
487 RP1 0.409091 0.842105
488 103 0.409091 0.837838
489 PAX 0.408 0.829268
490 KYE 0.407407 0.714286
491 FAD NBT 0.407143 0.75
492 BYC 0.406015 0.804598
493 1GZ 0.406015 0.795455
494 IRC 0.406015 0.813953
495 CA8 0.406015 0.729167
496 3CP 0.406015 0.804598
497 COW 0.406015 0.795455
498 HGG 0.406015 0.804598
499 COF 0.406015 0.786517
500 2KQ 0.406015 0.786517
501 G2P 0.405941 0.884615
502 KXW 0.405405 0.707317
503 SLU 0.404959 0.770115
504 RBZ 0.404494 0.849315
505 1CZ 0.404412 0.795455
506 Q2P 0.403361 0.674419
507 COA FLC 0.403226 0.790698
508 FAQ 0.402985 0.804598
509 BCA 0.402985 0.795455
510 4CA 0.402985 0.795455
511 MTP 0.402439 0.730769
512 8OD 0.402062 0.945205
513 HZ2 0.401786 0.731707
514 CO7 0.401515 0.804598
515 ENQ 0.4 0.916667
516 GMV 0.4 0.896104
517 HXC 0.4 0.786517
518 G2R 0.4 0.884615
519 GRA 0.4 0.804598
520 HF7 0.4 0.893333
Ligand no: 2; Ligand: ORN; Similar ligands found: 57
No: Ligand ECFP6 Tc MDL keys Tc
1 ORN 1 1
2 DLY 0.714286 0.961538
3 API 0.653846 0.785714
4 DAB 0.615385 0.888889
5 NLE 0.566667 0.724138
6 2YH 0.564103 0.757576
7 11C 0.548387 0.724138
8 UN1 0.548387 0.724138
9 0TF 0.536585 0.714286
10 LYS 0.53125 0.925926
11 DHH 0.53125 0.7
12 ONH 0.515152 0.735294
13 NPI 0.515152 0.7
14 2RA 0.5 0.785714
15 HSE 0.5 0.733333
16 6CL 0.5 0.758621
17 26P 0.5 0.65625
18 CIR 0.485714 0.735294
19 HCS 0.482759 0.814815
20 NVA 0.482759 0.714286
21 ARG 0.472222 0.757576
22 2NP 0.472222 0.6
23 DAR 0.472222 0.757576
24 MLZ 0.472222 0.757576
25 MLY 0.472222 0.631579
26 CUW 0.470588 0.833333
27 2YJ 0.465116 0.714286
28 MSE 0.454545 0.636364
29 2YG 0.454545 0.714286
30 DGN 0.451613 0.677419
31 DGL 0.451613 0.689655
32 GGL 0.451613 0.689655
33 GLU 0.451613 0.689655
34 GLN 0.451613 0.677419
35 DSN 0.444444 0.689655
36 ABA 0.444444 0.666667
37 DBB 0.444444 0.666667
38 SER 0.444444 0.689655
39 5CT 0.44186 0.735294
40 WT2 0.439024 0.78125
41 ILO 0.435897 0.757576
42 HRG 0.435897 0.757576
43 ALY 0.435897 0.735294
44 AS2 0.433333 0.62069
45 C2N 0.428571 0.703704
46 CYS 0.428571 0.740741
47 DCY 0.428571 0.740741
48 NOT 0.425 0.705882
49 EXY 0.425 0.611111
50 ONL 0.424242 0.625
51 2FM 0.416667 0.677419
52 HAR 0.414634 0.625
53 NMM 0.414634 0.714286
54 VUR 0.414634 0.735294
55 4JK 0.414634 0.714286
56 MET 0.411765 0.65625
57 MED 0.411765 0.65625
Similar Ligands (3D)
Ligand no: 1; Ligand: ADP; Similar ligands found: 65
No: Ligand Similarity coefficient
1 BMQ 1.0000
2 ADP ALF 0.9881
3 ADP AF3 0.9881
4 ADP VO4 0.9881
5 DGI 0.9763
6 GDP MG 0.9684
7 GDP BEF 0.9644
8 ALF GDP 0.9644
9 GDP ALF 0.9644
10 BEF GDP 0.9610
11 GDP AF3 0.9610
12 NYZ 0.9560
13 M7G 0.9527
14 GP2 0.9485
15 UDP 0.9410
16 G8D 0.9364
17 TYD 0.9340
18 CDP 0.9333
19 GCQ 0.9290
20 8GD 0.9252
21 CDP MG 0.9246
22 DUD 0.9233
23 YYY 0.9230
24 D4D 0.9127
25 KB7 0.9099
26 DUN 0.9081
27 TBD 0.9046
28 IMP 0.9020
29 IRP 0.8992
30 MGT 0.8986
31 FMP 0.8980
32 UDP UDP 0.8979
33 G3D 0.8938
34 UC5 0.8921
35 ALF 5GP 0.8902
36 7XL 0.8868
37 GTP MG 0.8843
38 XMP 0.8838
39 IMU 0.8829
40 MOD 0.8822
41 C8M 0.8795
42 A8M 0.8784
43 8OP 0.8777
44 DG 0.8750
45 DGP 0.8750
46 MSP 0.8735
47 G7M 0.8734
48 6MA 0.8734
49 6CG 0.8732
50 PFU 0.8701
51 FZT 0.8697
52 DBG 0.8693
53 DGT 0.8685
54 FZQ 0.8683
55 MZP 0.8680
56 93A 0.8679
57 S3N 0.8673
58 0RC 0.8661
59 TKW 0.8651
60 5FU 0.8637
61 FNU 0.8616
62 FZK 0.8607
63 UTP 0.8603
64 UP6 0.8572
65 NMN 0.8537
Ligand no: 2; Ligand: ORN; Similar ligands found: 879
No: Ligand Similarity coefficient
1 1M2 1.0000
2 2CO 0.9975
3 KMT 0.9841
4 HL5 0.9772
5 AKG 0.9758
6 MPJ 0.9731
7 LYN 0.9713
8 OGA 0.9692
9 FAN 0.9686
10 LEU 0.9656
11 S2G 0.9654
12 ASP 0.9649
13 9ON 0.9647
14 SHV 0.9609
15 AL0 0.9607
16 KQY 0.9585
17 OAA 0.9580
18 2IT 0.9578
19 SME 0.9571
20 HPN 0.9565
21 69O 0.9561
22 HTX 0.9545
23 CRN 0.9544
24 SD4 0.9543
25 SKJ 0.9540
26 MHO 0.9539
27 CSS 0.9526
28 PEA 0.9521
29 VKC 0.9520
30 9X7 0.9517
31 SLZ 0.9515
32 DAV 0.9507
33 LMR 0.9505
34 N6C 0.9498
35 GUA 0.9495
36 MD0 0.9487
37 URQ 0.9486
38 ASN 0.9485
39 HY1 0.9480
40 258 0.9480
41 PEL 0.9473
42 268 0.9472
43 7C3 0.9472
44 HSM 0.9470
45 6NA 0.9469
46 49F 0.9464
47 COI 0.9459
48 ACA 0.9456
49 TZE 0.9452
50 CXF 0.9447
51 YRL 0.9444
52 NLP 0.9443
53 AG2 0.9441
54 2HG 0.9432
55 CEE 0.9429
56 98J 0.9408
57 3OL 0.9403
58 3OM 0.9403
59 MLT 0.9403
60 HE2 0.9402
61 JZ7 0.9399
62 ILE 0.9392
63 PG3 0.9391
64 SGL 0.9383
65 MHN 0.9382
66 DIR 0.9377
67 5XA 0.9376
68 9J3 0.9372
69 2FT 0.9371
70 FP1 0.9370
71 BHH 0.9366
72 BNF 0.9364
73 SHO 0.9361
74 UGC 0.9360
75 DZA 0.9355
76 HP6 0.9355
77 ITN 0.9350
78 40E 0.9348
79 HE4 0.9347
80 BSX 0.9343
81 GJZ 0.9342
82 OCT 0.9340
83 PRA 0.9336
84 O8Y 0.9333
85 DHR 0.9332
86 ISZ 0.9330
87 1SP 0.9327
88 6XA 0.9324
89 GLY GLY 0.9323
90 SRT 0.9322
91 NMH 0.9321
92 I38 0.9321
93 ABU 0.9318
94 MLE 0.9317
95 IXW 0.9316
96 VAL 0.9314
97 8SZ 0.9313
98 PG0 0.9311
99 NTU 0.9311
100 271 0.9311
101 HBA 0.9309
102 264 0.9308
103 PEP 0.9307
104 O45 0.9307
105 THE 0.9307
106 MPH 0.9307
107 NWH 0.9304
108 N4B 0.9304
109 YIV 0.9301
110 A8C 0.9297
111 1DJ 0.9296
112 SIN 0.9295
113 0VT 0.9294
114 DPF 0.9293
115 S8V 0.9293
116 OK7 0.9290
117 16D 0.9290
118 NIZ 0.9287
119 IHG 0.9287
120 TAR 0.9287
121 2EH 0.9286
122 KOJ 0.9286
123 DAS 0.9281
124 CFI 0.9279
125 URP 0.9278
126 4JM 0.9278
127 261 0.9277
128 TZL 0.9277
129 LEA 0.9276
130 2LP 0.9276
131 QY9 0.9275
132 AJ3 0.9274
133 PHU 0.9272
134 CMS 0.9270
135 JYD 0.9269
136 TEO 0.9269
137 51F 0.9267
138 PZI 0.9264
139 SSN 0.9261
140 FOC 0.9258
141 42J 0.9258
142 THR 0.9258
143 B3M 0.9257
144 SPV 0.9257
145 NYL 0.9256
146 7OD 0.9256
147 PAC 0.9254
148 8GL 0.9253
149 LT1 0.9249
150 4VP 0.9248
151 LDP 0.9248
152 4XR 0.9248
153 JZ4 0.9245
154 PHB 0.9244
155 HGA 0.9244
156 CIZ 0.9244
157 HZP 0.9243
158 AEF 0.9241
159 263 0.9241
160 PGA 0.9240
161 1KA 0.9238
162 XRG 0.9238
163 PEQ 0.9237
164 DE5 0.9235
165 SEP 0.9235
166 MNN 0.9233
167 9YL 0.9231
168 OPE 0.9230
169 NF3 0.9227
170 GOJ 0.9225
171 7BC 0.9225
172 HC4 0.9224
173 BEZ 0.9224
174 DAL DAL 0.9221
175 I1E 0.9221
176 266 0.9220
177 4FA 0.9219
178 BHO 0.9215
179 RUJ 0.9211
180 SSB 0.9210
181 TIH 0.9209
182 MXN 0.9209
183 2RH 0.9207
184 OKG 0.9203
185 SKG 0.9202
186 RSO 0.9202
187 VAH 0.9202
188 BHL 0.9201
189 M4T 0.9200
190 DYT 0.9191
191 FEH 0.9191
192 SYM 0.9187
193 0L1 0.9186
194 3HG 0.9185
195 ZGL 0.9182
196 AC6 0.9181
197 FBJ 0.9179
198 OCA 0.9174
199 HX3 0.9172
200 PPR 0.9171
201 M3P 0.9170
202 A20 0.9169
203 HIS 0.9169
204 H8N 0.9166
205 3SL 0.9165
206 PAB 0.9163
207 TPA 0.9160
208 INO 0.9157
209 IOM 0.9156
210 LNO 0.9155
211 7WG 0.9155
212 HBX 0.9153
213 MSL 0.9151
214 OEG 0.9149
215 SYN 0.9148
216 PRY 0.9146
217 9YT 0.9143
218 BP9 0.9140
219 2AS 0.9139
220 J0Z 0.9139
221 XBT 0.9139
222 2BG 0.9137
223 2HO 0.9136
224 I4B 0.9136
225 4SD 0.9135
226 TLA 0.9135
227 OSE 0.9133
228 FK8 0.9133
229 1LN 0.9132
230 MAE 0.9131
231 Q9Z 0.9129
232 1DU 0.9129
233 ZBT 0.9128
234 TYL 0.9126
235 GZ3 0.9126
236 PAH 0.9125
237 ABN 0.9122
238 KMH 0.9119
239 KIV 0.9118
240 JFJ 0.9117
241 CHB 0.9117
242 MUC 0.9116
243 8EW 0.9113
244 SHA 0.9112
245 XLS 0.9111
246 NPO 0.9109
247 CCU 0.9108
248 HPV 0.9105
249 FUM 0.9102
250 BHU 0.9101
251 DHB 0.9101
252 3PG 0.9100
253 DCL 0.9100
254 HHI 0.9099
255 MEV 0.9099
256 NNO 0.9098
257 AHB 0.9097
258 4A3 0.9096
259 5XC 0.9096
260 6PC 0.9096
261 RBL 0.9095
262 BZ3 0.9095
263 GLY ALA 0.9093
264 717 0.9088
265 BEN 0.9088
266 1SH 0.9085
267 EV0 0.9085
268 F9P 0.9085
269 HDA 0.9085
270 P72 0.9082
271 6JN 0.9080
272 NSD 0.9080
273 2MI 0.9079
274 PBZ 0.9077
275 2AL 0.9076
276 BUB 0.9075
277 93K 0.9075
278 IZC 0.9074
279 BNS 0.9073
280 IHB 0.9073
281 0V5 0.9071
282 XIY 0.9071
283 1GP 0.9071
284 OOG 0.9071
285 FHB 0.9069
286 4NC 0.9068
287 9X6 0.9067
288 DPJ 0.9067
289 NBE 0.9067
290 TFB 0.9066
291 QDK 0.9066
292 ALA ALA 0.9065
293 PBC 0.9065
294 HIO 0.9064
295 XUL 0.9061
296 3LR 0.9061
297 HX2 0.9060
298 RB5 0.9060
299 RB0 0.9060
300 XYL 0.9060
301 DHI 0.9059
302 GRO 0.9057
303 HL4 0.9056
304 PYF 0.9055
305 4MV 0.9054
306 OEM 0.9051
307 PLU 0.9050
308 FPI 0.9050
309 PRO 0.9049
310 SS2 0.9049
311 BAM 0.9049
312 5XB 0.9047
313 TMH 0.9047
314 RBJ 0.9042
315 DEE 0.9042
316 9TW 0.9042
317 9CL 0.9041
318 DYA 0.9040
319 NXA 0.9039
320 ICF 0.9039
321 MEQ 0.9038
322 2PG 0.9038
323 FBM 0.9036
324 OVV 0.9030
325 Q07 0.9030
326 MRY 0.9028
327 7N0 0.9028
328 PYJ 0.9028
329 R9M 0.9027
330 PCA 0.9025
331 AMC 0.9025
332 7UC 0.9025
333 B24 0.9024
334 LLQ 0.9023
335 GAB 0.9022
336 3HM 0.9021
337 P9P 0.9020
338 HG3 0.9020
339 HSO 0.9019
340 4WL 0.9019
341 JLZ 0.9017
342 PO6 0.9017
343 TCA 0.9017
344 1F1 0.9015
345 6NT 0.9015
346 1AB 0.9015
347 3HB 0.9014
348 H95 0.9013
349 4JL 0.9013
350 EHM 0.9013
351 OTR 0.9012
352 AHN 0.9012
353 IF7 0.9011
354 URO 0.9009
355 XIZ 0.9009
356 1SA 0.9009
357 SS1 0.9008
358 URS 0.9005
359 ACH 0.9004
360 CCE 0.9003
361 PY7 0.9003
362 2ZM 0.9003
363 FW5 0.9002
364 XX2 0.9002
365 MWJ 0.9001
366 XSP 0.8998
367 OHG 0.8998
368 0HN 0.8998
369 M58 0.8997
370 APY 0.8996
371 BPW 0.8996
372 AE3 0.8996
373 K6V 0.8995
374 QOS 0.8995
375 MYJ 0.8995
376 AT3 0.8993
377 DHS 0.8993
378 R67 0.8992
379 SPD 0.8992
380 54D 0.8992
381 ROR 0.8991
382 R2B 0.8991
383 PHE 0.8989
384 3NY 0.8989
385 B3U 0.8983
386 FBB 0.8981
387 MZG 0.8981
388 NCA 0.8981
389 GLY CYS 0.8979
390 DHY 0.8978
391 FQI 0.8978
392 GAL 0.8978
393 AS3 0.8978
394 13P 0.8977
395 SMN 0.8977
396 4HP 0.8977
397 JZ5 0.8975
398 14J 0.8975
399 RJY 0.8975
400 1CO 0.8974
401 OC9 0.8973
402 R1X 0.8973
403 MRZ 0.8969
404 282 0.8968
405 AHR 0.8968
406 I2M 0.8967
407 4HA 0.8967
408 5FX 0.8966
409 4P5 0.8965
410 RMN 0.8962
411 HBD 0.8962
412 6NI 0.8961
413 GDE 0.8961
414 3SS 0.8961
415 AX3 0.8959
416 RNS 0.8959
417 K34 0.8959
418 MZT 0.8958
419 FBA 0.8958
420 53C 0.8957
421 069 0.8957
422 EOU 0.8957
423 NM3 0.8957
424 MZW 0.8952
425 0HO 0.8951
426 DGJ 0.8951
427 C2B 0.8949
428 URF 0.8948
429 G4D 0.8946
430 Y8I 0.8946
431 LDU 0.8945
432 3HP 0.8944
433 COM 0.8944
434 B40 0.8944
435 0OC 0.8943
436 J9T 0.8940
437 DSS 0.8940
438 NIO 0.8939
439 T9G 0.8939
440 1MR 0.8939
441 PE9 0.8937
442 FUD 0.8935
443 HYA 0.8933
444 M6W 0.8933
445 GLC 0.8932
446 MR1 0.8932
447 PUT 0.8932
448 IVL 0.8931
449 K6H 0.8929
450 DTL 0.8928
451 PGH 0.8928
452 BXO 0.8928
453 CHH 0.8927
454 45L 0.8926
455 LER 0.8924
456 RTK 0.8923
457 4LR 0.8923
458 P7Y 0.8923
459 KTA 0.8923
460 8X3 0.8923
461 3S5 0.8921
462 JZ3 0.8920
463 SC2 0.8919
464 97T 0.8919
465 650 0.8918
466 4ZA 0.8918
467 3YP 0.8917
468 5JC 0.8917
469 LPK 0.8917
470 RNT 0.8916
471 SOL 0.8915
472 8OZ 0.8914
473 LNR 0.8914
474 Z82 0.8914
475 SR1 0.8913
476 G3P 0.8913
477 CXP 0.8913
478 IP8 0.8912
479 DQY 0.8912
480 EDG 0.8910
481 ODV 0.8910
482 ASC 0.8909
483 LTL 0.8909
484 1H1 0.8907
485 SOR 0.8907
486 F9Y 0.8905
487 YPN 0.8904
488 HDH 0.8904
489 5OB 0.8903
490 173 0.8901
491 GPJ 0.8898
492 3OC 0.8898
493 3C4 0.8898
494 QMP 0.8897
495 NMG 0.8896
496 5HY 0.8894
497 OHP 0.8893
498 CCD 0.8892
499 SHF 0.8890
500 3PP 0.8890
501 TIU 0.8890
502 J9Q 0.8888
503 3NT 0.8887
504 PBA 0.8887
505 GPF 0.8887
506 3AL 0.8886
507 AEG 0.8886
508 4CL 0.8886
509 PNZ 0.8885
510 4XV 0.8885
511 JZ2 0.8885
512 AML 0.8885
513 PZM 0.8884
514 NFM 0.8883
515 A09 0.8883
516 152 0.8882
517 2HC 0.8882
518 4XS 0.8881
519 JDN 0.8879
520 PZA 0.8879
521 NOJ 0.8878
522 PIM 0.8877
523 MTL 0.8876
524 P3K 0.8874
525 GLO 0.8873
526 KDG 0.8872
527 MCT 0.8872
528 RAT 0.8871
529 PMB 0.8871
530 HCI 0.8870
531 3MB 0.8869
532 ORO 0.8865
533 3BU 0.8864
534 3AB 0.8863
535 IVA 0.8862
536 PAF 0.8862
537 J9N 0.8862
538 27Y 0.8862
539 8WO 0.8861
540 9RW 0.8861
541 SYC 0.8861
542 LUQ 0.8860
543 V55 0.8854
544 R9S 0.8854
545 GP9 0.8853
546 AOS 0.8852
547 LFC 0.8852
548 8WT 0.8852
549 VGL 0.8851
550 NTN 0.8851
551 C5A 0.8849
552 ABI 0.8849
553 129 0.8848
554 7VD 0.8848
555 HPS 0.8848
556 E4P 0.8847
557 E79 0.8846
558 CRS 0.8845
559 CDV 0.8843
560 ETX 0.8843
561 OVM 0.8843
562 PMF 0.8842
563 FB2 0.8840
564 BR9 0.8840
565 82I 0.8839
566 RIB 0.8839
567 ZZ3 0.8839
568 DMJ 0.8838
569 VPR 0.8837
570 UYA 0.8836
571 DHK 0.8835
572 G3H 0.8835
573 PBN 0.8832
574 23A 0.8830
575 AC0 0.8830
576 M45 0.8829
577 XM0 0.8827
578 3MV 0.8827
579 3H2 0.8826
580 XYD 0.8826
581 CP 0.8826
582 MLI 0.8824
583 4CS 0.8823
584 5AC 0.8822
585 ES9 0.8822
586 BML 0.8821
587 C2A 0.8820
588 5NI 0.8820
589 TAU 0.8819
590 278 0.8819
591 3XX 0.8818
592 23W 0.8817
593 PRO GLY 0.8817
594 K7M 0.8816
595 ETM 0.8816
596 HUI 0.8816
597 LYL 0.8813
598 2AC 0.8813
599 4JJ 0.8811
600 B2J 0.8811
601 41K 0.8810
602 PSJ 0.8807
603 R2P 0.8806
604 PDC 0.8806
605 JND 0.8806
606 X1S 0.8804
607 PYD 0.8802
608 TEG 0.8801
609 0MK 0.8801
610 P92 0.8800
611 IFL 0.8800
612 9SB 0.8800
613 DMV 0.8799
614 AEH 0.8798
615 EFS 0.8797
616 3A9 0.8797
617 KP6 0.8797
618 MAH 0.8796
619 0R0 0.8795
620 Q88 0.8794
621 AAE 0.8794
622 D1X 0.8793
623 HYP 0.8792
624 ABV 0.8792
625 H76 0.8791
626 QSC 0.8789
627 MPD 0.8789
628 FOM 0.8788
629 G2H 0.8786
630 9SE 0.8785
631 FSG 0.8782
632 HVQ 0.8781
633 HQJ 0.8781
634 PSE 0.8780
635 ANN 0.8778
636 3QM 0.8776
637 S76 0.8776
638 IMR 0.8775
639 ESP 0.8774
640 POA 0.8773
641 2A7 0.8773
642 SSC 0.8773
643 CYX 0.8772
644 RUU 0.8772
645 OXC 0.8770
646 PKU 0.8770
647 R20 0.8770
648 OVP 0.8770
649 L99 0.8770
650 2YU 0.8769
651 2BX 0.8768
652 OMD 0.8766
653 286 0.8766
654 A1U 0.8766
655 BRT 0.8766
656 VX 0.8766
657 BZX 0.8765
658 S2P 0.8765
659 54G 0.8763
660 DOR 0.8762
661 4HM 0.8762
662 32O 0.8762
663 BUA 0.8761
664 SYV 0.8760
665 MZ0 0.8759
666 2EZ 0.8757
667 KPL 0.8754
668 P80 0.8753
669 34A 0.8753
670 TPO 0.8753
671 I3A 0.8752
672 L5V 0.8752
673 CHT 0.8751
674 MAN 0.8751
675 FYU 0.8751
676 HGQ 0.8751
677 7MU 0.8749
678 2MP 0.8749
679 G8M 0.8749
680 HFA 0.8748
681 MNM 0.8748
682 7A8 0.8747
683 SKM 0.8746
684 BZ2 0.8746
685 BAL 0.8746
686 P81 0.8746
687 2HE 0.8746
688 03W 0.8743
689 2KT 0.8739
690 S0H 0.8739
691 DTU 0.8739
692 DFB 0.8736
693 IFM 0.8734
694 OW4 0.8733
695 XBZ 0.8730
696 GVM 0.8729
697 OXZ 0.8728
698 6TZ 0.8728
699 F06 0.8726
700 PAE 0.8725
701 8H8 0.8725
702 ESX 0.8724
703 NBN 0.8724
704 HMH 0.8724
705 GZL 0.8724
706 ISD 0.8723
707 MLA 0.8723
708 GLA 0.8721
709 B85 0.8719
710 4CH 0.8719
711 IOL 0.8718
712 BVC 0.8718
713 XPO 0.8717
714 MWM 0.8717
715 52C 0.8717
716 BDR 0.8716
717 2D0 0.8716
718 AMH 0.8716
719 NFA 0.8715
720 PPY 0.8713
721 MPV 0.8710
722 QSB 0.8710
723 F12 0.8709
724 EKZ 0.8704
725 HMU 0.8703
726 APG 0.8702
727 N9J 0.8701
728 4SX 0.8700
729 MSF 0.8699
730 SLP 0.8699
731 HT4 0.8698
732 WCE 0.8697
733 KVP 0.8693
734 TYE 0.8693
735 GIF 0.8692
736 E5X 0.8692
737 PIY 0.8691
738 LY0 0.8690
739 F0J 0.8690
740 EMZ 0.8688
741 23J 0.8687
742 FUB 0.8686
743 EUG 0.8686
744 T6C 0.8686
745 AGK 0.8685
746 NVI 0.8684
747 GTQ 0.8683
748 2D8 0.8682
749 CPZ 0.8681
750 H7Y 0.8678
751 SHI 0.8678
752 A3M 0.8677
753 X0V 0.8677
754 R8A 0.8676
755 RM1 0.8676
756 5M0 0.8674
757 2F6 0.8673
758 8GC 0.8672
759 ASO 0.8671
760 PRI 0.8670
761 PEZ 0.8670
762 DTT 0.8668
763 1P3 0.8667
764 HHH 0.8666
765 OW7 0.8666
766 PC 0.8664
767 SAF 0.8663
768 VOH 0.8661
769 34D 0.8661
770 4HS 0.8661
771 SPA 0.8661
772 BMD 0.8660
773 Z6J 0.8657
774 ZZT 0.8657
775 AZF 0.8656
776 FA0 0.8654
777 ZXD 0.8654
778 J6W 0.8654
779 TH0 0.8653
780 6LW 0.8653
781 5RG 0.8653
782 FJO 0.8652
783 NSP 0.8652
784 A5E 0.8651
785 8ZE 0.8647
786 TB6 0.8646
787 X6X 0.8646
788 3PY 0.8646
789 ES2 0.8645
790 6M4 0.8644
791 DII 0.8644
792 5HN 0.8643
793 2FG 0.8638
794 QSH 0.8636
795 DOB 0.8636
796 1DV 0.8635
797 MTG 0.8635
798 4FH 0.8634
799 2PN 0.8632
800 2H5 0.8630
801 G2F 0.8629
802 JB8 0.8627
803 IT2 0.8626
804 A29 0.8625
805 BPN 0.8624
806 259 0.8623
807 IPU 0.8622
808 BNL 0.8622
809 KTW 0.8620
810 PCT 0.8619
811 GCO 0.8617
812 PRZ 0.8615
813 ITU 0.8614
814 TSS 0.8613
815 MBG 0.8612
816 SMV 0.8611
817 F4E 0.8610
818 IPB 0.8609
819 3HL 0.8608
820 2DR 0.8607
821 AX7 0.8607
822 BHA 0.8607
823 24B 0.8607
824 PPV 0.8606
825 URC 0.8606
826 8TX 0.8605
827 RUY 0.8605
828 4M0 0.8604
829 GBN 0.8604
830 P2D 0.8603
831 A3B 0.8601
832 5MK 0.8600
833 149 0.8599
834 SNU 0.8599
835 7MH 0.8598
836 GVG 0.8598
837 SAT 0.8598
838 3BB 0.8596
839 4NM 0.8596
840 N7I 0.8595
841 HDL 0.8593
842 3DM 0.8593
843 BMA 0.8592
844 4LW 0.8590
845 FCR 0.8590
846 1P8 0.8589
847 SMB 0.8587
848 TBP 0.8587
849 6FZ 0.8585
850 DGY 0.8581
851 GAF 0.8581
852 1L5 0.8580
853 2HU 0.8580
854 MES 0.8580
855 PRS 0.8579
856 174 0.8578
857 ICB 0.8577
858 N2I 0.8576
859 1A7 0.8576
860 1GN 0.8576
861 HX4 0.8575
862 IFP 0.8575
863 AW5 0.8569
864 HF2 0.8568
865 4JT 0.8558
866 AFS 0.8557
867 BVG 0.8556
868 P7I 0.8556
869 DPN 0.8554
870 1BN 0.8554
871 PH3 0.8546
872 FA1 0.8541
873 EOL 0.8538
874 8K2 0.8533
875 KVV 0.8531
876 GLY PRO 0.8522
877 40F 0.8520
878 5VM 0.8520
879 JF6 0.8519
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1M15; Ligand: ADP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 1m15.bio1) has 34 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1M15; Ligand: ARG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 1m15.bio1) has 34 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback