Receptor
PDB id Resolution Class Description Source Keywords
3ZZH 2.1 Å EC: 2.7.2.8 CRYSTAL STRUCTURE OF THE AMINO ACID KINASE DOMAIN FROM SACCH CEREVISIAE ACETYLGLUTAMATE KINASE IN COMPLEX WITH ITS F EED-BACK INHIBITOR L-ARGININE SACCHAROMYCES CEREVISIAE TRANSFERASE ARGININE BIOSYNTHESIS
Ref.: INSIGHT ON AN ARGININE SYNTHESIS METABOLON FROM THE TETRAMERIC STRUCTURE OF YEAST ACETYLGLUTAMATE KINAS PLOS ONE V. 7 34734 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ARG C:1362;
Valid;
none;
submit data
175.209 C6 H15 N4 O2 C(C[C...
CL A:1359;
B:1367;
C:1360;
D:1367;
D:1368;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
submit data
35.453 Cl [Cl-]
EDO A:1353;
A:1354;
A:1355;
A:1356;
A:1357;
A:1358;
B:1351;
B:1352;
B:1353;
B:1354;
B:1355;
B:1356;
B:1357;
B:1358;
B:1359;
B:1360;
B:1361;
B:1362;
B:1363;
B:1364;
B:1365;
B:1366;
C:1351;
C:1352;
C:1353;
C:1354;
C:1355;
C:1356;
C:1357;
C:1358;
D:1352;
D:1353;
D:1354;
D:1355;
D:1356;
D:1357;
D:1358;
D:1359;
D:1360;
D:1361;
D:1362;
D:1363;
D:1364;
D:1365;
D:1366;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
62.068 C2 H6 O2 C(CO)...
GOL C:1359;
Invalid;
none;
submit data
92.094 C3 H8 O3 C(C(C...
MLI A:1360;
B:1368;
D:1369;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
102.046 C3 H2 O4 C(C(=...
NLG A:1361;
B:1369;
C:1361;
D:1370;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
189.166 C7 H11 N O5 CC(=O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3ZZH 2.1 Å EC: 2.7.2.8 CRYSTAL STRUCTURE OF THE AMINO ACID KINASE DOMAIN FROM SACCH CEREVISIAE ACETYLGLUTAMATE KINASE IN COMPLEX WITH ITS F EED-BACK INHIBITOR L-ARGININE SACCHAROMYCES CEREVISIAE TRANSFERASE ARGININE BIOSYNTHESIS
Ref.: INSIGHT ON AN ARGININE SYNTHESIS METABOLON FROM THE TETRAMERIC STRUCTURE OF YEAST ACETYLGLUTAMATE KINAS PLOS ONE V. 7 34734 2012
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3ZZH - NLG C7 H11 N O5 CC(=O)N[C@....
2 3ZZF Ki = 400 mM NLG C7 H11 N O5 CC(=O)N[C@....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3ZZH - NLG C7 H11 N O5 CC(=O)N[C@....
2 3ZZF Ki = 400 mM NLG C7 H11 N O5 CC(=O)N[C@....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3ZZH - NLG C7 H11 N O5 CC(=O)N[C@....
2 3ZZF Ki = 400 mM NLG C7 H11 N O5 CC(=O)N[C@....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ARG; Similar ligands found: 47
No: Ligand ECFP6 Tc MDL keys Tc
1 DAR 1 1
2 ARG 1 1
3 CIR 0.735294 0.763158
4 AAR 0.705882 0.783784
5 ILO 0.615385 0.783784
6 3AR 0.595238 0.891892
7 4JK 0.585366 0.789474
8 NMM 0.585366 0.888889
9 HAR 0.585366 0.780488
10 VUR 0.585366 0.810811
11 VIO 0.581395 0.769231
12 WT2 0.571429 0.805556
13 DA2 0.55814 0.744186
14 2YH 0.545455 0.65
15 3KJ 0.545455 0.680851
16 2MR 0.545455 0.864865
17 1KJ 0.533333 0.744186
18 JM2 0.533333 0.731707
19 NRG 0.521739 0.622642
20 RPI 0.521739 0.64
21 2YJ 0.521739 0.619048
22 API 0.515152 0.611111
23 LN6 0.510638 0.725
24 JM7 0.5 0.731707
25 ARG VAL 0.5 0.744186
26 HRG 0.5 0.941176
27 LYS ARG LYS ARG LYS ARG LYS ARG 0.5 0.848485
28 AS1 0.489796 0.8
29 D20 0.489796 0.744186
30 2KJ 0.489796 0.727273
31 ORN 0.472222 0.757576
32 JM4 0.470588 0.697674
33 JM6 0.470588 0.697674
34 JM8 0.470588 0.714286
35 MLZ 0.463415 0.65
36 ARG ASP 0.461538 0.744186
37 JM5 0.461538 0.714286
38 ARG GLU 0.45283 0.761905
39 DLY 0.447368 0.735294
40 DAB 0.441176 0.685714
41 LYS 0.435897 0.764706
42 0TF 0.428571 0.619048
43 2YG 0.42 0.619048
44 ALA ARG 0.42 0.780488
45 PG3 0.416667 0.756757
46 6CL 0.414634 0.638889
47 BEZ NLE LYS ARG OAR 0.413793 0.75
Ligand no: 2; Ligand: NLG; Similar ligands found: 23
No: Ligand ECFP6 Tc MDL keys Tc
1 NLG 1 1
2 NLQ 0.69697 0.903226
3 AN0 0.606061 0.83871
4 X2W 0.547619 0.682927
5 AME 0.540541 0.722222
6 AOR 0.540541 0.764706
7 SAC 0.53125 0.757576
8 D6E 0.52381 0.684211
9 SC2 0.515152 0.75
10 MUD 0.511628 0.65
11 BC8 0.5 0.722222
12 KSN 0.488372 0.787879
13 G01 0.487179 0.634146
14 16E 0.477273 0.8125
15 OLN 0.47619 0.692308
16 NIG 0.473684 0.69697
17 AAG 0.454545 0.634146
18 8DM 0.446809 0.702703
19 RDM 0.434783 0.8125
20 SN0 0.428571 0.84375
21 AE5 0.428571 0.605263
22 3O3 0.418605 0.605263
23 QRG 0.408163 0.682927
Similar Ligands (3D)
Ligand no: 1; Ligand: ARG; Similar ligands found: 663
No: Ligand Similarity coefficient
1 2M7 1.0000
2 GGB 0.9987
3 MLY 0.9957
4 NPI 0.9877
5 IAR 0.9808
6 6HN 0.9763
7 EXY 0.9757
8 DHH 0.9716
9 ABH 0.9712
10 JX7 0.9650
11 ZZU 0.9621
12 26P 0.9575
13 L06 0.9562
14 LVD 0.9550
15 NNH 0.9549
16 M3L 0.9547
17 AHL 0.9544
18 EGV 0.9522
19 HOC 0.9487
20 ENW 0.9464
21 2FM 0.9456
22 4DI 0.9455
23 ENV 0.9446
24 LPB 0.9434
25 E8U 0.9434
26 PML 0.9432
27 FB6 0.9418
28 CLT 0.9417
29 2NP 0.9415
30 11C 0.9411
31 GVA 0.9410
32 UN1 0.9406
33 NOT 0.9392
34 4ZD 0.9385
35 9YT 0.9379
36 SZ7 0.9358
37 AHN 0.9352
38 011 0.9351
39 TEG 0.9349
40 OOG 0.9343
41 4TB 0.9342
42 ONH 0.9341
43 58X 0.9339
44 OCA 0.9336
45 M3P 0.9334
46 SLZ 0.9329
47 Z70 0.9329
48 HFA 0.9326
49 2OR 0.9326
50 5AB 0.9322
51 S2C 0.9322
52 P80 0.9321
53 XRS 0.9321
54 LPA 0.9316
55 N8C 0.9313
56 ALY 0.9308
57 FK8 0.9307
58 PHE 0.9305
59 XRX 0.9303
60 MF3 0.9298
61 PBA 0.9284
62 LYN 0.9275
63 A51 0.9262
64 8AC 0.9262
65 N9J 0.9260
66 1HS 0.9259
67 NFZ 0.9256
68 9J6 0.9255
69 64Z 0.9254
70 DHC 0.9247
71 LUQ 0.9238
72 KAP 0.9233
73 GRQ 0.9231
74 DDK 0.9230
75 NFA 0.9227
76 J9Y 0.9226
77 MHN 0.9223
78 6C4 0.9221
79 AOY 0.9217
80 HIC 0.9217
81 7OD 0.9216
82 GB5 0.9212
83 M1T 0.9212
84 HCI 0.9211
85 KDG 0.9210
86 KNA 0.9208
87 DNN 0.9207
88 TYR 0.9205
89 HJD 0.9205
90 F98 0.9205
91 DA3 0.9204
92 1N5 0.9202
93 Q9Z 0.9201
94 YZM 0.9198
95 CXP 0.9196
96 AG2 0.9195
97 DKA 0.9193
98 LZ5 0.9190
99 SB7 0.9188
100 DXG 0.9185
101 1PS 0.9183
102 DZA 0.9182
103 4YZ 0.9182
104 PFF 0.9180
105 DTY 0.9179
106 5OY 0.9175
107 YOF 0.9174
108 KPV 0.9173
109 CCU 0.9173
110 DAH 0.9171
111 7XA 0.9171
112 FXY 0.9169
113 3YP 0.9168
114 11X 0.9168
115 6C5 0.9166
116 5PV 0.9163
117 M6H 0.9161
118 EN1 0.9161
119 RGP 0.9159
120 PRO GLY 0.9159
121 DDW 0.9158
122 GLR 0.9158
123 3H2 0.9154
124 XI7 0.9153
125 TCA 0.9153
126 HC4 0.9152
127 ODI 0.9149
128 3GZ 0.9149
129 B3U 0.9142
130 T03 0.9141
131 O45 0.9141
132 AE3 0.9140
133 OC9 0.9137
134 PO6 0.9137
135 HLP 0.9134
136 PBN 0.9132
137 DLT 0.9131
138 P81 0.9131
139 P7Y 0.9129
140 5KJ 0.9128
141 G3M 0.9126
142 TB8 0.9126
143 6C9 0.9125
144 HGA 0.9124
145 HPP 0.9121
146 4TP 0.9120
147 C82 0.9120
148 P93 0.9119
149 AHC 0.9117
150 0L1 0.9115
151 IVL 0.9115
152 HPL 0.9113
153 6FG 0.9113
154 E79 0.9112
155 650 0.9112
156 SPD 0.9112
157 TZM 0.9109
158 PPT 0.9109
159 DER 0.9106
160 KPC 0.9105
161 DIR 0.9103
162 XOG 0.9103
163 CUW 0.9093
164 TZP 0.9090
165 1BN 0.9090
166 NSD 0.9084
167 OJD 0.9083
168 JFM 0.9082
169 S2P 0.9081
170 4BF 0.9080
171 HIS 0.9079
172 ENO 0.9079
173 IYR 0.9079
174 2JJ 0.9078
175 PHI 0.9073
176 0A9 0.9068
177 J4K 0.9065
178 DIA 0.9064
179 AOT 0.9064
180 LL2 0.9063
181 TYC 0.9063
182 3VQ 0.9061
183 S0W 0.9061
184 MJW 0.9060
185 PPY 0.9059
186 EYJ 0.9058
187 OYA 0.9058
188 Q06 0.9055
189 KPA 0.9054
190 XIZ 0.9054
191 SB9 0.9052
192 MD6 0.9050
193 RP3 0.9050
194 5LD 0.9050
195 S8V 0.9046
196 TYE 0.9044
197 S7D 0.9037
198 848 0.9036
199 DPN 0.9035
200 2J3 0.9034
201 I58 0.9033
202 7C3 0.9030
203 GZ2 0.9030
204 KTA 0.9029
205 D10 0.9028
206 GAE 0.9028
207 7BC 0.9027
208 BNF 0.9024
209 F90 0.9023
210 KQY 0.9022
211 TOH 0.9021
212 4LW 0.9020
213 37E 0.9018
214 5TO 0.9013
215 SHV 0.9013
216 NWH 0.9012
217 6MW 0.9012
218 G14 0.9010
219 EQA 0.9010
220 ACA 0.9009
221 4LV 0.9008
222 IJ6 0.9005
223 1H1 0.9002
224 GO2 0.9000
225 AZM 0.8999
226 1L5 0.8998
227 FOM 0.8997
228 ISA 0.8996
229 C53 0.8995
230 HX8 0.8988
231 ODK 0.8987
232 KLS 0.8986
233 4BX 0.8984
234 HNL 0.8984
235 R10 0.8983
236 3PG 0.8981
237 DHM 0.8981
238 HPO 0.8981
239 7UC 0.8978
240 3QO 0.8978
241 SHI 0.8978
242 BRH 0.8978
243 3IP 0.8977
244 GLY GLY GLY 0.8975
245 HSA 0.8973
246 PH3 0.8973
247 B40 0.8972
248 QFJ 0.8972
249 5DL 0.8972
250 MES 0.8969
251 HG3 0.8969
252 AKG 0.8966
253 SEP 0.8965
254 HL4 0.8965
255 RA7 0.8964
256 8SZ 0.8963
257 4Z0 0.8962
258 ZZA 0.8962
259 SOJ 0.8961
260 7R4 0.8961
261 NMH 0.8960
262 DXP 0.8960
263 492 0.8958
264 PA5 0.8957
265 SSC 0.8957
266 DEZ 0.8956
267 0A1 0.8956
268 YIE 0.8955
269 S0A 0.8952
270 MMS 0.8949
271 HPN 0.8947
272 9GB 0.8946
273 2HC 0.8944
274 DYT 0.8941
275 HXY 0.8941
276 4FE 0.8940
277 TPM 0.8939
278 4XF 0.8937
279 268 0.8936
280 FER 0.8935
281 JF5 0.8935
282 QH3 0.8931
283 ABF 0.8931
284 X48 0.8928
285 S8D 0.8927
286 EQW 0.8925
287 KLE 0.8925
288 BSA 0.8924
289 GJK 0.8922
290 F06 0.8921
291 LLH 0.8920
292 VC3 0.8919
293 JPQ 0.8918
294 6Q3 0.8918
295 ALE 0.8915
296 36M 0.8915
297 D4G 0.8914
298 ALA GLU 0.8913
299 258 0.8911
300 GLU 0.8911
301 0NX 0.8909
302 92G 0.8909
303 TBJ 0.8909
304 7MW 0.8908
305 GGG 0.8908
306 R9J 0.8907
307 DI6 0.8907
308 MEQ 0.8906
309 PAU 0.8905
310 RQD 0.8904
311 D8Q 0.8904
312 6HO 0.8904
313 GNW 0.8903
314 9VQ 0.8903
315 13P 0.8903
316 9C2 0.8902
317 YIP 0.8900
318 BZQ 0.8900
319 TMG 0.8899
320 3VW 0.8898
321 M5E 0.8897
322 M74 0.8896
323 2FX 0.8893
324 PRA 0.8892
325 OGA 0.8892
326 IPO 0.8892
327 GCO 0.8891
328 HJH 0.8890
329 QUS 0.8890
330 A5E 0.8887
331 B41 0.8886
332 GOE 0.8886
333 BL0 0.8884
334 BHU 0.8882
335 I2E 0.8880
336 E0O 0.8879
337 0XR 0.8878
338 N6C 0.8877
339 HX4 0.8877
340 3CX 0.8875
341 SNR 0.8875
342 YPN 0.8873
343 M5B 0.8872
344 CUQ 0.8871
345 K6V 0.8868
346 5DS 0.8868
347 5XA 0.8867
348 KYN 0.8866
349 YIH 0.8865
350 5O5 0.8865
351 GVY 0.8865
352 795 0.8864
353 LT1 0.8864
354 4KJ 0.8862
355 7O4 0.8861
356 DMA 0.8861
357 Y3L 0.8860
358 56D 0.8860
359 S8G 0.8858
360 AT3 0.8857
361 3OL 0.8855
362 3OM 0.8855
363 14W 0.8854
364 PMV 0.8854
365 R5P 0.8853
366 263 0.8853
367 1X4 0.8850
368 R2P 0.8850
369 6XA 0.8849
370 6C8 0.8849
371 SSB 0.8848
372 S0F 0.8847
373 FHC 0.8847
374 BP7 0.8846
375 DX5 0.8846
376 8CC 0.8845
377 61M 0.8845
378 1YO 0.8845
379 LXP 0.8845
380 I38 0.8845
381 6FR 0.8844
382 OHJ 0.8844
383 TIH 0.8844
384 47V 0.8842
385 4FP 0.8842
386 GLN 0.8841
387 FHV 0.8838
388 ONL 0.8837
389 RAT 0.8837
390 6ZX 0.8835
391 P58 0.8834
392 A5P 0.8833
393 RE4 0.8832
394 IAC 0.8830
395 XCG 0.8829
396 ATX 0.8829
397 FB5 0.8829
398 CS2 0.8827
399 G3P 0.8827
400 7VP 0.8827
401 BVS 0.8826
402 5SP 0.8826
403 H35 0.8825
404 QIV 0.8825
405 IPE 0.8824
406 RP5 0.8823
407 LX1 0.8823
408 CCD 0.8820
409 D3G 0.8818
410 NYL 0.8817
411 ASF 0.8816
412 XDE 0.8816
413 54F 0.8815
414 EOU 0.8815
415 68B 0.8812
416 MVH 0.8812
417 E4P 0.8809
418 AMQ 0.8809
419 2D2 0.8808
420 Q04 0.8807
421 G3H 0.8807
422 M75 0.8805
423 HHI 0.8802
424 FZM 0.8802
425 NTU 0.8800
426 DED 0.8800
427 M45 0.8799
428 ZIP 0.8799
429 SME 0.8799
430 HPV 0.8798
431 TRP 0.8798
432 CXH 0.8797
433 HSX 0.8795
434 RES 0.8794
435 L22 0.8794
436 QME 0.8793
437 GB4 0.8790
438 6P3 0.8790
439 XQI 0.8789
440 2IT 0.8789
441 GGL 0.8789
442 N7I 0.8788
443 1OV 0.8787
444 PTB 0.8786
445 BZM 0.8786
446 9BF 0.8786
447 3XH 0.8785
448 2FT 0.8784
449 0ON 0.8783
450 PLP 0.8781
451 A3M 0.8781
452 JMG 0.8780
453 DHI 0.8780
454 9B3 0.8780
455 MSL 0.8780
456 DGL 0.8779
457 22F 0.8778
458 X1R 0.8777
459 NF3 0.8777
460 0OL 0.8776
461 HL6 0.8775
462 4CF 0.8771
463 S2G 0.8771
464 0K7 0.8770
465 P3S 0.8769
466 1VK 0.8765
467 363 0.8764
468 E3X 0.8762
469 CBE 0.8761
470 NK5 0.8759
471 27K 0.8759
472 BNL 0.8759
473 5H6 0.8758
474 BPW 0.8757
475 YE6 0.8755
476 MPV 0.8755
477 FWD 0.8755
478 1A5 0.8754
479 A5H 0.8754
480 Y4L 0.8754
481 6L6 0.8753
482 9JT 0.8753
483 N2Y 0.8752
484 EYV 0.8751
485 5WN 0.8751
486 LR2 0.8750
487 6J5 0.8750
488 GUA 0.8747
489 B3M 0.8746
490 WA2 0.8744
491 5OO 0.8743
492 S0D 0.8743
493 JCZ 0.8742
494 FF2 0.8741
495 KTJ 0.8740
496 TX4 0.8739
497 SYM 0.8739
498 5WZ 0.8736
499 DGN 0.8735
500 3VX 0.8735
501 TL6 0.8733
502 IOP 0.8733
503 IP8 0.8731
504 0QA 0.8731
505 9ON 0.8731
506 A8K 0.8729
507 3HG 0.8729
508 LDP 0.8729
509 GPJ 0.8728
510 GPF 0.8728
511 S6P 0.8727
512 5RP 0.8727
513 152 0.8727
514 D2G 0.8725
515 1Z6 0.8725
516 SOL 0.8725
517 FZ3 0.8724
518 U4G 0.8723
519 PLR 0.8721
520 2HG 0.8717
521 CFA 0.8717
522 9SE 0.8717
523 8GL 0.8716
524 ZRK 0.8716
525 MNP 0.8713
526 J9N 0.8712
527 6SD 0.8712
528 GP9 0.8711
529 KMY 0.8710
530 OCT 0.8710
531 URO 0.8708
532 SOR 0.8707
533 KMH 0.8705
534 WA1 0.8705
535 ERZ 0.8703
536 TLM 0.8702
537 0OY 0.8701
538 LO1 0.8700
539 HWD 0.8700
540 LSQ 0.8700
541 4Z3 0.8699
542 DHY 0.8698
543 RKV 0.8698
544 MHO 0.8697
545 LJ1 0.8696
546 3C4 0.8696
547 3VS 0.8695
548 XX3 0.8695
549 F6R 0.8694
550 N91 0.8694
551 HNM 0.8692
552 CPZ 0.8692
553 XDK 0.8691
554 3S5 0.8691
555 50C 0.8690
556 BQ2 0.8690
557 FCD 0.8687
558 MUK 0.8687
559 JAH 0.8683
560 41K 0.8682
561 M6R 0.8682
562 IPR 0.8681
563 PGH 0.8681
564 PAN 0.8681
565 MT2 0.8680
566 MSR 0.8678
567 8CV 0.8677
568 OKP 0.8674
569 SNU 0.8673
570 D1G 0.8672
571 1HR 0.8669
572 V15 0.8669
573 K7M 0.8669
574 CIY 0.8667
575 U13 0.8667
576 3CR 0.8666
577 129 0.8666
578 3D3 0.8659
579 ZEA 0.8655
580 CHH 0.8655
581 PC 0.8655
582 CCE 0.8653
583 F18 0.8652
584 1GP 0.8651
585 X6P 0.8649
586 AEH 0.8648
587 2ED 0.8648
588 H4E 0.8645
589 CK2 0.8645
590 HE8 0.8642
591 TID 0.8642
592 KTW 0.8642
593 VM1 0.8641
594 EIP 0.8641
595 HHH 0.8640
596 IOS 0.8637
597 0SY 0.8636
598 DST 0.8636
599 ALA ALA 0.8635
600 JZA 0.8634
601 0OP 0.8633
602 EGR 0.8632
603 FPL 0.8631
604 ISY 0.8630
605 RUJ 0.8630
606 ESX 0.8629
607 A5Q 0.8628
608 5VU 0.8627
609 D9Z 0.8626
610 B21 0.8626
611 MET 0.8623
612 TAG 0.8622
613 AAN 0.8620
614 GLO 0.8618
615 YTX 0.8616
616 RNO 0.8615
617 IWT 0.8614
618 XEN 0.8612
619 F4E 0.8611
620 ICT 0.8608
621 J6W 0.8607
622 36Y 0.8605
623 OJM 0.8605
624 DTR 0.8604
625 G6Q 0.8601
626 G6P 0.8599
627 C5A 0.8599
628 PSE 0.8598
629 A29 0.8598
630 RTK 0.8597
631 ESP 0.8595
632 80G 0.8590
633 AEF 0.8589
634 F63 0.8589
635 STT 0.8588
636 SNO 0.8588
637 BZE 0.8587
638 K6H 0.8586
639 SX2 0.8586
640 AMH 0.8584
641 ESI 0.8581
642 3LJ 0.8580
643 55D 0.8580
644 6TZ 0.8579
645 78Y 0.8577
646 EVF 0.8576
647 1A7 0.8569
648 428 0.8565
649 LNR 0.8564
650 8YH 0.8562
651 NM3 0.8562
652 9ZE 0.8561
653 R20 0.8557
654 7EH 0.8550
655 YTZ 0.8550
656 6PG 0.8548
657 DTB 0.8546
658 M1Z 0.8545
659 AFS 0.8534
660 6KT 0.8531
661 0F3 0.8517
662 AGP 0.8514
663 CWD 0.8510
Ligand no: 2; Ligand: NLG; Similar ligands found: 172
No: Ligand Similarity coefficient
1 HCT 0.9819
2 HJ7 0.9435
3 HCA 0.9432
4 G88 0.9415
5 0GY 0.9383
6 NCD 0.9354
7 7QD 0.9319
8 GLY MET 0.9285
9 RSM 0.9285
10 SSM 0.9282
11 ICT 0.9275
12 CIT 0.9268
13 ALA GLN 0.9267
14 5XW 0.9213
15 AVO 0.9204
16 FLC 0.9192
17 ALA GLU 0.9161
18 TRA 0.9147
19 1AL 0.9114
20 GLY ASP 0.9106
21 P4B 0.9096
22 AQK 0.9090
23 CDT 0.9081
24 ALA LEU 0.9076
25 2ED 0.9075
26 EKN 0.9073
27 GLY LEU 0.9070
28 ACE PHE 0.9063
29 ING 0.9056
30 DG2 0.9041
31 TRC 0.9040
32 CCB 0.9036
33 DJN 0.9031
34 ALA LYS 0.9023
35 OTD 0.9021
36 AQQ 0.9000
37 4WK 0.9000
38 HHT 0.8996
39 PRE 0.8992
40 PCV 0.8991
41 5UK 0.8990
42 OKM 0.8981
43 BZS 0.8979
44 MIC 0.8974
45 NQM 0.8970
46 AVJ 0.8964
47 MMN 0.8958
48 MNP 0.8958
49 DMA 0.8956
50 8V0 0.8952
51 OMD 0.8944
52 X1R 0.8941
53 87L 0.8933
54 TNG 0.8932
55 0GZ 0.8926
56 7UZ 0.8919
57 MN9 0.8914
58 5LD 0.8912
59 DI9 0.8904
60 41K 0.8898
61 14W 0.8897
62 BRR 0.8896
63 M75 0.8896
64 S24 0.8892
65 NFQ 0.8883
66 ALA DGL 0.8880
67 NTC 0.8875
68 DI6 0.8872
69 0FA 0.8871
70 PMV 0.8848
71 XQB 0.8841
72 MZM 0.8840
73 X6P 0.8839
74 ISJ 0.8836
75 4A5 0.8836
76 M5B 0.8835
77 40F 0.8829
78 LHY 0.8828
79 IFG 0.8823
80 40H 0.8817
81 7A3 0.8816
82 DNF 0.8813
83 23N 0.8811
84 LEL 0.8804
85 FWB 0.8799
86 HLD 0.8797
87 ASF 0.8795
88 J01 0.8792
89 P23 0.8790
90 PJL 0.8789
91 TSR 0.8786
92 5XB 0.8784
93 NGA 0.8779
94 VPR 0.8778
95 6R8 0.8777
96 2PG 0.8775
97 AVI 0.8775
98 7A2 0.8775
99 3CR 0.8771
100 CE2 0.8768
101 DZA 0.8766
102 3S6 0.8764
103 9BF 0.8758
104 REL 0.8758
105 IPE 0.8757
106 SSC 0.8752
107 CS2 0.8749
108 C26 0.8748
109 5RP 0.8744
110 9SE 0.8736
111 U1K 0.8736
112 PPK 0.8731
113 AOZ 0.8729
114 NVU 0.8728
115 R1P 0.8727
116 5TO 0.8719
117 C4L 0.8718
118 T2D 0.8717
119 XEN 0.8715
120 MTL 0.8710
121 F12 0.8708
122 IAC 0.8702
123 IS3 0.8698
124 TX4 0.8697
125 O2Y 0.8696
126 8WQ 0.8695
127 U7E 0.8695
128 DLT 0.8692
129 VM1 0.8690
130 DXP 0.8686
131 2UZ 0.8683
132 43W 0.8682
133 LSQ 0.8680
134 3MF 0.8678
135 HQ9 0.8677
136 A5P 0.8675
137 NBB 0.8675
138 2C0 0.8674
139 NPA 0.8672
140 UN1 0.8672
141 NSG 0.8672
142 OW7 0.8671
143 2CG 0.8666
144 3S4 0.8665
145 0CG 0.8655
146 IOP 0.8655
147 NZ2 0.8654
148 S3P 0.8650
149 CSN 0.8650
150 AH8 0.8644
151 GVM 0.8644
152 GNL 0.8642
153 QUS 0.8639
154 PD2 0.8635
155 TZM 0.8632
156 RES 0.8630
157 MAH 0.8630
158 IOS 0.8627
159 LFC 0.8621
160 263 0.8621
161 KDO 0.8611
162 INF 0.8602
163 PA5 0.8597
164 P80 0.8589
165 RD4 0.8580
166 DER 0.8579
167 XYH 0.8564
168 2EH 0.8559
169 AKG 0.8558
170 2F6 0.8555
171 EWG 0.8554
172 K48 0.8544
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3ZZH; Ligand: NLG; 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: 3zzh.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3ZZH; Ligand: NLG; 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: 3zzh.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3ZZH; Ligand: NLG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 3zzh.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3ZZH; Ligand: NLG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 3zzh.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 3ZZH; 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: 5) in the query (biounit: 3zzh.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
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