Receptor
PDB id Resolution Class Description Source Keywords
1ESQ 2.5 Å EC: 2.7.1.50 CRYSTAL STRUCTURE OF THIAZOLE KINASE MUTANT (C198S) WITH ATP THIAZOLE PHOSPHATE. BACILLUS SUBTILIS TRIMER ALPHA-BETA PROTEIN TRANSFERASE
Ref.: CRYSTAL STRUCTURE OF 4-METHYL-5-BETA-HYDROXYETHYLTH KINASE FROM BACILLUS SUBTILIS AT 1.5 A RESOLUTION. BIOCHEMISTRY V. 39 7868 2000
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ATP A:300;
B:305;
C:310;
 Valid;
Valid;
Valid;
 none;
none;
none;
 submit data
507.181 C10 H16 N5 O13 P3 c1nc(...
MG B:345;
B:360;
C:355;
C:350;
A:340;
A:365;
 Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
 none;
none;
none;
none;
none;
none;
 submit data
24.305 Mg [Mg+2...
SO4 B:370;
 Invalid;
 none;
 submit data
96.063 O4 S [O-]S...
TZP A:320;
B:325;
C:330;
 Valid;
Valid;
Valid;
 none;
none;
none;
 submit data
223.187 C6 H10 N O4 P S Cc1c(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1C3Q 2 Å EC: 2.7.1.50 CRYSTAL STRUCTURE OF NATIVE THIAZOLE KINASE IN THE MONOCLINI BACILLUS SUBTILIS ALPHA-BETA ATP BINDING KINASE TRANSFERASE
Ref.: CRYSTAL STRUCTURE OF 4-METHYL-5-BETA-HYDROXYETHYLTH KINASE FROM BACILLUS SUBTILIS AT 1.5 A RESOLUTION. BIOCHEMISTRY V. 39 7868 2000
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1ESQ - TZP C6 H10 N O4 P S Cc1c(scn1)....
2 1EKK - TZE C6 H9 N O S Cc1c(scn1)....
3 1C3Q - TZE C6 H9 N O S Cc1c(scn1)....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1ESQ - TZP C6 H10 N O4 P S Cc1c(scn1)....
2 1EKK - TZE C6 H9 N O S Cc1c(scn1)....
3 1C3Q - TZE C6 H9 N O S Cc1c(scn1)....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5CGA - KP6 C8 H14 N2 O Cc1c(c(n(n....
2 5COJ - TZE C6 H9 N O S Cc1c(scn1)....
3 5CGE - 51F C6 H10 N2 O Cc1nccn1CC....
4 1ESQ - TZP C6 H10 N O4 P S Cc1c(scn1)....
5 1EKK - TZE C6 H9 N O S Cc1c(scn1)....
6 1C3Q - TZE C6 H9 N O S Cc1c(scn1)....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ATP; Similar ligands found: 489
No: Ligand ECFP6 Tc MDL keys Tc
1 ATP 1 1
2 HEJ 1 1
3 AQP 0.985507 1
4 5FA 0.985507 1
5 AP5 0.927536 0.971831
6 B4P 0.927536 0.971831
7 BA3 0.913043 0.971831
8 ADP 0.9 1
9 A2D 0.884058 0.971831
10 AGS 0.84 0.945946
11 6YZ 0.833333 0.972222
12 AT4 0.810811 0.958904
13 AN2 0.810811 0.985915
14 25L 0.809524 0.985915
15 APR 0.802632 0.971831
16 AR6 0.802632 0.971831
17 M33 0.8 0.958333
18 ACQ 0.794872 0.972222
19 TAT 0.794872 0.958904
20 T99 0.794872 0.958904
21 AD9 0.792208 0.972222
22 ACP 0.789474 0.972222
23 A 0.788732 0.971429
24 AMP 0.788732 0.971429
25 ANP 0.772152 0.972222
26 HQG 0.756098 0.985915
27 CA0 0.753247 0.945205
28 ADX 0.753247 0.873418
29 A22 0.746988 0.985915
30 50T 0.74359 0.958333
31 KG4 0.74359 0.945205
32 PRX 0.734177 0.893333
33 APC 0.734177 0.958904
34 ABM 0.733333 0.917808
35 45A 0.733333 0.917808
36 ATF 0.731707 0.958904
37 7D4 0.730769 0.905405
38 ITT 0.730769 0.943662
39 AMP MG 0.72973 0.929577
40 ADQ 0.729412 0.945205
41 A3R 0.729412 0.907895
42 AP2 0.714286 0.958904
43 A12 0.714286 0.958904
44 A1R 0.709302 0.907895
45 SRA 0.706667 0.918919
46 JNT 0.701149 0.945205
47 5AL 0.698795 0.931507
48 8LE 0.698795 0.894737
49 ADP MG 0.696203 0.943662
50 ADP BEF 0.696203 0.943662
51 JSQ 0.695122 0.945946
52 HFD 0.695122 0.945946
53 9X8 0.693182 0.92
54 OAD 0.693182 0.945205
55 AU1 0.6875 0.972222
56 APC MG 0.682927 0.917808
57 8LH 0.682353 0.906667
58 SRP 0.682353 0.906667
59 G5P 0.680851 0.921053
60 25A 0.678161 0.971831
61 OZV 0.678161 0.971831
62 3OD 0.677778 0.945205
63 4AD 0.670455 0.92
64 G3A 0.670213 0.921053
65 8LQ 0.666667 0.906667
66 QA7 0.666667 0.894737
67 00A 0.662921 0.883117
68 ADP PO3 0.662651 0.943662
69 RBY 0.662651 0.932432
70 ADV 0.662651 0.932432
71 ATP MG 0.662651 0.943662
72 BIS 0.659341 0.933333
73 5SV 0.659091 0.848101
74 OOB 0.659091 0.931507
75 8QN 0.659091 0.931507
76 GTA 0.65625 0.886076
77 KMQ 0.655914 0.932432
78 BEF ADP 0.654762 0.917808
79 UP5 0.653061 0.92
80 AMO 0.651685 0.932432
81 PAJ 0.651685 0.884615
82 VO4 ADP 0.651163 0.945205
83 2A5 0.650602 0.918919
84 MAP 0.647727 0.945946
85 3AT 0.647059 0.971831
86 AHX 0.644444 0.896104
87 DLL 0.644444 0.931507
88 ATR 0.642857 0.971429
89 PAP 0.642857 0.985714
90 PTJ 0.641304 0.896104
91 V2G 0.639535 0.896104
92 7D3 0.6375 0.905405
93 3UK 0.637363 0.918919
94 SON 0.634146 0.932432
95 A4P 0.633663 0.843373
96 ANP MG 0.632184 0.931507
97 ALF ADP 0.632184 0.87013
98 LAD 0.630435 0.860759
99 PR8 0.630435 0.85
100 B5V 0.630435 0.906667
101 WAQ 0.630435 0.883117
102 AFH 0.628866 0.884615
103 LMS 0.628205 0.82716
104 DTP 0.627907 0.905405
105 GAP 0.627907 0.893333
106 TXA 0.623656 0.932432
107 ME8 0.623656 0.839506
108 NB8 0.623656 0.896104
109 1ZZ 0.623656 0.839506
110 FYA 0.623656 0.905405
111 DQV 0.622449 0.958333
112 T5A 0.621359 0.841463
113 XYA 0.619718 0.84507
114 RAB 0.619718 0.84507
115 ADN 0.619718 0.84507
116 DAL AMP 0.611111 0.905405
117 9SN 0.610526 0.871795
118 48N 0.61 0.896104
119 AP0 0.607843 0.896104
120 9ZD 0.604396 0.907895
121 9ZA 0.604396 0.907895
122 B5M 0.604167 0.894737
123 B5Y 0.604167 0.894737
124 FA5 0.604167 0.906667
125 NAX 0.60396 0.873418
126 DND 0.60396 0.932432
127 NAI 0.60396 0.907895
128 6V0 0.60396 0.896104
129 TXD 0.60396 0.907895
130 ADP BMA 0.602151 0.918919
131 A2R 0.6 0.985915
132 OMR 0.598039 0.851852
133 TXE 0.598039 0.907895
134 XAH 0.597938 0.839506
135 7DT 0.593023 0.985714
136 AOC 0.592593 0.821918
137 L3W 0.592233 0.932432
138 4UV 0.591837 0.894737
139 DDS 0.590909 0.878378
140 139 0.590476 0.873418
141 CNA 0.584906 0.932432
142 6AD 0.58427 0.909091
143 5AS 0.583333 0.77907
144 5N5 0.581081 0.819444
145 GA7 0.58 0.906667
146 4UU 0.58 0.894737
147 4TC 0.576923 0.896104
148 ADJ 0.575472 0.851852
149 5CD 0.573333 0.805556
150 A4D 0.573333 0.819444
151 RGT 0.571429 0.958904
152 A3P 0.571429 0.971429
153 7D5 0.56962 0.878378
154 LAQ 0.568627 0.839506
155 NO7 0.565217 0.932432
156 F2R 0.564815 0.864198
157 80F 0.563636 0.841463
158 CUU 0.563218 0.971831
159 YLP 0.563107 0.819277
160 UPA 0.561905 0.907895
161 AV2 0.56044 0.917808
162 COD 0.559633 0.811765
163 4UW 0.557692 0.860759
164 JB6 0.556701 0.883117
165 3AM 0.555556 0.929577
166 ATP A 0.555556 0.930556
167 ATP A A A 0.555556 0.930556
168 A2P 0.552941 0.957143
169 TYM 0.552381 0.906667
170 NA7 0.552083 0.958904
171 EP4 0.551282 0.753247
172 MYR AMP 0.55102 0.817073
173 PPS 0.549451 0.873418
174 YLB 0.54717 0.819277
175 YLC 0.54717 0.839506
176 DAT 0.545455 0.905405
177 NAD 0.545455 0.931507
178 H1Q 0.545455 0.90411
179 G5A 0.544444 0.77907
180 DTA 0.544304 0.786667
181 M2T 0.544304 0.734177
182 3DH 0.54321 0.773333
183 128 0.542857 0.776471
184 AHZ 0.538462 0.817073
185 SSA 0.537634 0.8
186 GTP 0.537634 0.92
187 MTA 0.5375 0.773333
188 IOT 0.537037 0.831325
189 A3D 0.535714 0.918919
190 AR6 AR6 0.533981 0.917808
191 ARG AMP 0.533981 0.829268
192 7MD 0.533981 0.8625
193 YLA 0.53211 0.819277
194 IMO 0.529412 0.929577
195 AMP DBH 0.529412 0.893333
196 TAD 0.528846 0.884615
197 AYB 0.527273 0.809524
198 HDV 0.526882 0.893333
199 A5A 0.526882 0.807229
200 TSB 0.526316 0.819277
201 EAD 0.525424 0.873418
202 2AM 0.52439 0.943662
203 6RE 0.52381 0.759494
204 6MZ 0.523256 0.930556
205 7DD 0.522727 0.985714
206 CZF 0.521739 0.931507
207 V3L 0.521739 0.971831
208 AVV 0.520833 0.896104
209 BTX 0.517857 0.841463
210 NAE 0.517241 0.894737
211 QBQ 0.516129 0.906667
212 52H 0.515789 0.77907
213 VMS 0.515789 0.788235
214 54H 0.515789 0.788235
215 NSS 0.515464 0.8
216 BT5 0.513274 0.831325
217 NAQ 0.512821 0.871795
218 ZAS 0.511905 0.766234
219 A3N 0.511628 0.786667
220 J7C 0.511628 0.769231
221 5X8 0.511111 0.763158
222 5CA 0.510417 0.8
223 53H 0.510417 0.77907
224 8X1 0.510417 0.752809
225 NVA LMS 0.510204 0.752809
226 ARU 0.510204 0.860759
227 ALF ADP 3PG 0.509259 0.8375
228 AF3 ADP 3PG 0.509259 0.8375
229 38V 0.508475 0.886076
230 ZID 0.508475 0.918919
231 P1H 0.508197 0.851852
232 OVE 0.505882 0.905405
233 S4M 0.505747 0.666667
234 LEU LMS 0.50505 0.730337
235 LPA AMP 0.504673 0.817073
236 NAD TDB 0.504587 0.917808
237 7MC 0.504587 0.841463
238 NAD IBO 0.504587 0.917808
239 D4F 0.504274 0.839506
240 P5A 0.5 0.744444
241 DZD 0.5 0.884615
242 DSZ 0.5 0.8
243 MAO 0.5 0.759036
244 DSH 0.5 0.725
245 LSS 0.5 0.761364
246 FB0 0.5 0.804598
247 NDE 0.495935 0.932432
248 N0B 0.495798 0.819277
249 M24 0.495726 0.85
250 YLY 0.495726 0.809524
251 NJP 0.495575 0.945946
252 9K8 0.49505 0.714286
253 MGP 0.494737 0.884615
254 6C6 0.494624 0.881579
255 O02 0.494624 0.921053
256 NWW 0.493671 0.760563
257 NAJ PZO 0.491379 0.848101
258 0WD 0.491228 0.921053
259 6G0 0.489583 0.884615
260 GJV 0.488636 0.75
261 6FA 0.488189 0.841463
262 5AD 0.486842 0.746479
263 KAA 0.485149 0.752809
264 GSU 0.485149 0.77907
265 71V 0.483146 0.907895
266 NEC 0.482759 0.746667
267 A3G 0.482759 0.8
268 ODP 0.482456 0.909091
269 K3K 0.480769 0.802632
270 FAS 0.48062 0.851852
271 FAD 0.48062 0.851852
272 7D7 0.480519 0.743243
273 FDA 0.480315 0.833333
274 N6P 0.48 0.915493
275 2SA 0.479167 0.932432
276 GP3 0.478723 0.921053
277 AMP NAD 0.478261 0.905405
278 SFG 0.478261 0.75
279 4TA 0.478261 0.807229
280 NDP 0.477876 0.921053
281 NPW 0.477876 0.886076
282 LQJ 0.47619 0.917808
283 NDC 0.47619 0.871795
284 YSA 0.47619 0.77907
285 NAJ PYZ 0.475 0.807229
286 MGO 0.474227 0.860759
287 NZQ 0.473684 0.909091
288 TXP 0.473684 0.921053
289 6IA 0.473684 0.8375
290 GDP 0.473684 0.92
291 A7D 0.472527 0.776316
292 J4G 0.470588 0.92
293 SFD 0.469231 0.734043
294 SA8 0.468085 0.707317
295 A5D 0.468085 0.786667
296 ZDA 0.468085 0.864865
297 12D 0.46789 0.785714
298 PGS 0.467391 0.883117
299 MHZ 0.467391 0.697674
300 8PZ 0.466667 0.8
301 62F 0.466165 0.8625
302 D5M 0.465909 0.878378
303 DA 0.465909 0.878378
304 GGZ 0.464646 0.825
305 SAH 0.463158 0.74359
306 SAI 0.463158 0.734177
307 FAY 0.462687 0.8625
308 Y3J 0.4625 0.726027
309 B1U 0.462264 0.736264
310 PO4 PO4 A A A A PO4 0.460784 0.902778
311 AAM 0.460674 0.971429
312 RFL 0.459259 0.821429
313 SMM 0.459184 0.686047
314 HF7 0.459184 0.893333
315 C2R 0.458824 0.90411
316 AMZ 0.458824 0.916667
317 SAM 0.458333 0.690476
318 K3E 0.457944 0.792208
319 A3S 0.456522 0.810811
320 FNK 0.455224 0.804598
321 7C5 0.453704 0.818182
322 AAT 0.453608 0.707317
323 EEM 0.453608 0.690476
324 NWQ 0.453488 0.739726
325 XNP 0.452991 0.873418
326 PRT 0.45283 0.931507
327 K2R 0.451923 0.88
328 AIR 0.451219 0.901408
329 62X 0.45098 0.666667
330 KOY 0.45045 0.802632
331 GSP 0.45 0.873418
332 ETB 0.45 0.833333
333 DCA 0.45 0.823529
334 N5O 0.449438 0.763158
335 NIA 0.448276 0.822785
336 A3T 0.446809 0.821918
337 K15 0.446602 0.682353
338 PUA 0.446281 0.884615
339 QXP 0.445545 0.785714
340 6K6 0.445545 0.930556
341 GEK 0.445545 0.7375
342 4YB 0.445455 0.761364
343 V47 0.444444 0.783784
344 S7M 0.444444 0.690476
345 DG1 0.443548 0.921053
346 1DG 0.443548 0.921053
347 Z5A 0.443548 0.77907
348 COA 0.442623 0.823529
349 0T1 0.442623 0.823529
350 WSA 0.442478 0.788235
351 8BR 0.43956 0.906667
352 N5A 0.43956 0.736842
353 DZ4 0.438776 0.881579
354 8Q2 0.438596 0.772727
355 101 0.438202 0.878378
356 IDP 0.4375 0.918919
357 NVA 2AD 0.4375 0.759494
358 9JJ 0.435714 0.8625
359 KY2 0.435644 0.731707
360 NAP 0.435484 0.945205
361 K2W 0.435185 0.740741
362 APU 0.434783 0.894737
363 7RP 0.433333 0.928571
364 QXG 0.432692 0.776471
365 A6D 0.432692 0.722892
366 TAP 0.432 0.907895
367 AMX 0.432 0.833333
368 COS 0.432 0.804598
369 CAO 0.432 0.795455
370 J7V 0.432 0.833333
371 30N 0.432 0.752688
372 V1N 0.431193 0.917808
373 KL2 0.430233 0.837838
374 K38 0.429907 0.779221
375 649 0.429825 0.744444
376 P5F 0.429577 0.823529
377 NA0 0.428571 0.932432
378 7RA 0.428571 0.957747
379 SCO 0.428571 0.823529
380 R2V 0.428571 0.785714
381 CMX 0.428571 0.823529
382 0UM 0.427184 0.698795
383 KYB 0.427184 0.731707
384 GAV 0.427184 0.884615
385 1RB 0.426966 0.885714
386 QQY 0.426966 0.815789
387 ACK 0.426966 0.861111
388 GCP 0.425743 0.896104
389 G1R 0.425743 0.907895
390 ACO 0.425197 0.795455
391 FCX 0.425197 0.795455
392 FAM 0.425197 0.804598
393 OZP 0.424779 0.728395
394 O05 0.424528 0.843373
395 GNH 0.424242 0.907895
396 F2N 0.423611 0.813953
397 K2H 0.423077 0.75641
398 GKE 0.422018 0.884615
399 GDC 0.422018 0.884615
400 K3H 0.422018 0.75
401 GDD 0.422018 0.884615
402 KYE 0.422018 0.714286
403 HAX 0.421875 0.804598
404 3AD 0.421687 0.805556
405 9GM 0.421569 0.896104
406 GNP 0.421569 0.896104
407 FA9 0.42069 0.864198
408 TM1 0.420561 0.77381
409 KY5 0.420561 0.725
410 KB1 0.420561 0.698795
411 9BG 0.420168 0.896104
412 H6Y 0.42 0.945205
413 2MC 0.419847 0.769231
414 KXW 0.419643 0.707317
415 FYN 0.418605 0.823529
416 3KK 0.418605 0.804598
417 S8M 0.417476 0.759494
418 7L1 0.417323 0.795455
419 26A 0.416667 0.763158
420 2VA 0.416667 0.8
421 NHD 0.416667 0.905405
422 HZ2 0.415929 0.731707
423 QQX 0.41573 0.805195
424 CA6 0.415385 0.729167
425 OXK 0.415385 0.804598
426 MCD 0.415385 0.804598
427 SOP 0.415385 0.804598
428 COK 0.415385 0.804598
429 YZS 0.415385 0.729167
430 KGP 0.415385 0.729167
431 KY8 0.415094 0.728395
432 K2K 0.415094 0.7375
433 FAJ 0.414966 0.831325
434 NX8 0.414141 0.716049
435 Q34 0.413793 0.674419
436 YE1 0.413534 0.813953
437 RMB 0.413043 0.873239
438 FAI 0.413043 0.916667
439 AS 0.413043 0.833333
440 CO6 0.412214 0.804598
441 1VU 0.412214 0.795455
442 NMX 0.412214 0.76087
443 CMC 0.412214 0.804598
444 SXZ 0.411215 0.710843
445 ANZ 0.410714 0.8
446 SCA 0.410448 0.804598
447 SCD 0.409091 0.823529
448 CAJ 0.409091 0.804598
449 NAD BBN 0.408759 0.841463
450 HY8 0.408696 0.731707
451 EO7 0.408602 0.788235
452 D3Y 0.407767 0.789474
453 CC5 0.407407 0.816901
454 KGA 0.407407 0.744681
455 KH3 0.40708 0.674419
456 PLP AAD 0.406504 0.733333
457 SLU 0.406504 0.770115
458 G 0.40625 0.906667
459 5GP 0.40625 0.906667
460 MLC 0.406015 0.804598
461 KGJ 0.406015 0.752688
462 1HE 0.406015 0.786517
463 3HC 0.406015 0.813953
464 A1S 0.406015 0.804598
465 IVC 0.406015 0.813953
466 BCO 0.406015 0.804598
467 GTG 0.405405 0.886076
468 NMN AMP PO4 0.404959 0.87013
469 Q2P 0.404959 0.674419
470 3D1 0.404762 0.773333
471 3L1 0.404762 0.773333
472 2BA 0.404255 0.915493
473 CMP 0.404255 0.901408
474 VRT 0.40404 0.769231
475 SO8 0.40404 0.789474
476 MCA 0.402985 0.795455
477 COO 0.402985 0.804598
478 CAA 0.402985 0.813953
479 SO5 0.402985 0.721649
480 LCV 0.402985 0.721649
481 NAD CJ3 0.402878 0.811765
482 3NZ 0.401869 0.782051
483 G2R 0.401869 0.884615
484 YXS 0.4 0.729167
485 2CP 0.4 0.795455
486 2FA 0.4 0.813333
487 YXR 0.4 0.729167
488 ZZB 0.4 0.77381
489 MC4 0.4 0.76087
Ligand no: 2; Ligand: TZP; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 TZP 1 1
2 TZE 0.488372 0.604167
3 3NM 0.436364 0.92
Similar Ligands (3D)
Ligand no: 1; Ligand: ATP; Similar ligands found: 41
No: Ligand Similarity coefficient
1 ADP AF3 0.9964
2 ADP ALF 0.9801
3 ADP VO4 0.9704
4 BEF GDP 0.9696
5 GDP ALF 0.9646
6 GDP AF3 0.9633
7 GDP BEF 0.9621
8 ALF GDP 0.9621
9 DBG 0.9581
10 CTP 0.9340
11 UTP 0.9337
12 GDP MG 0.9246
13 DGT 0.9177
14 DCP 0.9141
15 DCP MG 0.9114
16 8DG 0.9051
17 MGT 0.9049
18 6U4 0.8990
19 2KH 0.8972
20 MSP 0.8951
21 TTP 0.8917
22 MOD 0.8909
23 8GT 0.8879
24 G2P 0.8852
25 DGI 0.8847
26 2TM 0.8819
27 L3U 0.8814
28 M7G 0.8804
29 GP2 0.8802
30 DUT 0.8788
31 UNP 0.8786
32 Y9Z 0.8773
33 F6G 0.8769
34 DUP 0.8755
35 GH3 0.8730
36 D3T 0.8684
37 0RC 0.8650
38 BUP 0.8621
39 DUT MG 0.8599
40 UDP 0.8570
41 TYR AMP 0.8561
Ligand no: 2; Ligand: TZP; Similar ligands found: 367
No: Ligand Similarity coefficient
1 1PS 0.9716
2 JFM 0.9513
3 KPA 0.9454
4 LVD 0.9363
5 M3L 0.9362
6 5OY 0.9362
7 5LD 0.9349
8 XRS 0.9344
9 F98 0.9327
10 MF3 0.9294
11 MLY 0.9293
12 2JJ 0.9261
13 ABF 0.9253
14 AHN 0.9239
15 4TB 0.9201
16 6HN 0.9199
17 ENW 0.9186
18 PPY 0.9181
19 A5P 0.9166
20 EVF 0.9161
21 5DL 0.9155
22 S2C 0.9154
23 HCI 0.9147
24 S7A 0.9146
25 TZM 0.9136
26 6J5 0.9135
27 3GZ 0.9135
28 DHC 0.9134
29 FOM 0.9134
30 37E 0.9117
31 61M 0.9117
32 PHE 0.9115
33 GO2 0.9109
34 E4P 0.9108
35 4ZD 0.9105
36 MD6 0.9103
37 SB7 0.9095
38 2FM 0.9092
39 ARG 0.9090
40 Q04 0.9090
41 TOH 0.9088
42 RP5 0.9087
43 OOG 0.9079
44 AZM 0.9075
45 PBN 0.9074
46 RP3 0.9070
47 GRF 0.9065
48 Q06 0.9048
49 4TP 0.9040
50 DER 0.9039
51 SKF 0.9034
52 N9J 0.9032
53 PLP 0.9031
54 SG3 0.9031
55 DHH 0.9030
56 NPI 0.9030
57 M6H 0.9028
58 J0Z 0.9023
59 QFJ 0.9023
60 DEZ 0.9021
61 LX1 0.9020
62 GGB 0.9020
63 M5E 0.9019
64 3H2 0.9017
65 848 0.9015
66 P81 0.9013
67 UN1 0.9012
68 SB9 0.9010
69 TU0 0.9007
70 DX5 0.9007
71 5WN 0.9006
72 API 0.9005
73 5RP 0.9004
74 HFA 0.9003
75 XRX 0.9003
76 Q9Z 0.9002
77 P58 0.9002
78 MES 0.9000
79 1L5 0.8995
80 11C 0.8991
81 TB8 0.8987
82 HC4 0.8985
83 DPN 0.8983
84 HSX 0.8983
85 N2M 0.8983
86 PLR 0.8982
87 JX7 0.8982
88 8U3 0.8981
89 MP5 0.8979
90 ZEC 0.8978
91 3QO 0.8971
92 MJW 0.8968
93 ENV 0.8967
94 2VQ 0.8965
95 NNH 0.8963
96 5PV 0.8961
97 HPP 0.8960
98 ENO 0.8957
99 IAR 0.8957
100 M3P 0.8954
101 2FX 0.8953
102 SYE 0.8952
103 1VQ 0.8950
104 DHM 0.8949
105 TCA 0.8947
106 CXP 0.8945
107 4LV 0.8945
108 ILO 0.8941
109 KPC 0.8941
110 CIR 0.8939
111 LSQ 0.8938
112 PBA 0.8938
113 QIV 0.8936
114 YOF 0.8934
115 3PG 0.8934
116 HNL 0.8933
117 KYN 0.8930
118 DTY 0.8925
119 PLP PMP 0.8922
120 5OO 0.8919
121 LUQ 0.8918
122 TYR 0.8913
123 BG6 0.8911
124 AOY 0.8910
125 R2P 0.8910
126 PMP 0.8908
127 2NP 0.8908
128 3IP 0.8902
129 R5P 0.8902
130 6Q3 0.8901
131 RES 0.8901
132 S7G 0.8900
133 S2P 0.8898
134 QH3 0.8898
135 PCS 0.8897
136 XCG 0.8897
137 11X 0.8895
138 EYV 0.8894
139 S8G 0.8894
140 EQA 0.8893
141 F1P 0.8892
142 LYS 0.8891
143 TX4 0.8890
144 NFA 0.8889
145 XI7 0.8887
146 HL4 0.8886
147 1YO 0.8885
148 C0H 0.8884
149 EN1 0.8884
150 5SP 0.8883
151 DXP 0.8882
152 3YP 0.8881
153 D9Z 0.8880
154 A51 0.8877
155 XIZ 0.8875
156 6CL 0.8875
157 F06 0.8873
158 LL2 0.8872
159 AOT 0.8872
160 33S 0.8872
161 26P 0.8869
162 P80 0.8866
163 KLS 0.8865
164 STT 0.8865
165 F90 0.8864
166 G6P 0.8864
167 0A9 0.8863
168 GO8 0.8862
169 M6P 0.8860
170 7C3 0.8855
171 DAR 0.8853
172 RGP 0.8849
173 GZ2 0.8847
174 FER 0.8844
175 TOM 0.8841
176 2UB 0.8841
177 3VW 0.8838
178 TMG 0.8838
179 AHC 0.8838
180 HF2 0.8837
181 4LW 0.8837
182 S8V 0.8837
183 DA3 0.8836
184 PRO GLY 0.8832
185 PPT 0.8831
186 IP8 0.8830
187 OJD 0.8827
188 DAH 0.8827
189 YZM 0.8826
190 HNK 0.8824
191 HMS 0.8824
192 GRQ 0.8824
193 WT2 0.8821
194 P7Y 0.8821
195 YIP 0.8819
196 HSA 0.8815
197 JPQ 0.8813
198 7OD 0.8811
199 S0W 0.8809
200 DI6 0.8809
201 2MR 0.8806
202 9BF 0.8803
203 1HS 0.8801
204 2HC 0.8800
205 I2E 0.8797
206 EXY 0.8791
207 AT3 0.8791
208 ATX 0.8790
209 GNW 0.8789
210 DXG 0.8787
211 ALE 0.8787
212 BGP 0.8783
213 1X4 0.8783
214 GAE 0.8778
215 PXP 0.8774
216 IOP 0.8772
217 PNP 0.8765
218 GVA 0.8765
219 58X 0.8765
220 PO6 0.8765
221 D6G 0.8761
222 C82 0.8760
223 PC 0.8760
224 650 0.8759
225 PUE 0.8758
226 EGV 0.8757
227 4FP 0.8753
228 GJK 0.8751
229 TYC 0.8751
230 MMS 0.8748
231 GB4 0.8748
232 SZ7 0.8744
233 C53 0.8744
234 LZ5 0.8744
235 HXY 0.8742
236 ZZU 0.8742
237 FK8 0.8741
238 0L1 0.8738
239 IYR 0.8737
240 PRA 0.8737
241 GLR 0.8737
242 6C5 0.8737
243 J4K 0.8735
244 4XF 0.8735
245 G14 0.8732
246 LPB 0.8732
247 HAR 0.8732
248 PA5 0.8730
249 6C9 0.8730
250 JOV 0.8726
251 DHI 0.8725
252 9GB 0.8724
253 6MW 0.8723
254 R10 0.8723
255 TYE 0.8722
256 3VX 0.8721
257 T03 0.8720
258 NMM 0.8720
259 4R1 0.8720
260 DZA 0.8719
261 BVA 0.8717
262 TRP 0.8715
263 GB5 0.8714
264 5TO 0.8713
265 S7D 0.8712
266 6FG 0.8710
267 3LJ 0.8710
268 ZZA 0.8708
269 N7I 0.8707
270 EQW 0.8707
271 6XA 0.8707
272 6C8 0.8705
273 GPJ 0.8702
274 4NS 0.8701
275 HHI 0.8700
276 F18 0.8696
277 64Z 0.8693
278 KDG 0.8693
279 4BX 0.8692
280 KPV 0.8691
281 LGT 0.8691
282 PML 0.8691
283 9JT 0.8689
284 3XH 0.8687
285 FZM 0.8687
286 J9Y 0.8685
287 MPP 0.8685
288 HJD 0.8684
289 3VQ 0.8684
290 YE6 0.8683
291 7O4 0.8683
292 6ZX 0.8681
293 54F 0.8681
294 TA6 0.8679
295 ODK 0.8677
296 ZIP 0.8676
297 MRU 0.8675
298 XQI 0.8674
299 TEG 0.8673
300 N91 0.8672
301 2LT 0.8669
302 E8U 0.8668
303 YIE 0.8667
304 N2Y 0.8666
305 14W 0.8664
306 SOJ 0.8661
307 H35 0.8661
308 DIR 0.8660
309 M6D 0.8658
310 JMG 0.8656
311 36M 0.8655
312 6L6 0.8655
313 BSA 0.8653
314 URO 0.8652
315 SX2 0.8651
316 B41 0.8649
317 263 0.8648
318 KLE 0.8647
319 68B 0.8642
320 HGA 0.8640
321 FCD 0.8637
322 4Z9 0.8635
323 GXD 0.8634
324 GPF 0.8632
325 5KJ 0.8630
326 YIH 0.8629
327 NFZ 0.8627
328 N4B 0.8627
329 GLP 0.8626
330 7R4 0.8624
331 ONH 0.8624
332 7ZL 0.8623
333 CFA 0.8618
334 F6P 0.8618
335 HHV 0.8616
336 NOT 0.8610
337 RQD 0.8607
338 4FE 0.8607
339 7UC 0.8605
340 DTR 0.8603
341 PAU 0.8603
342 CBE 0.8602
343 ERZ 0.8602
344 YPN 0.8601
345 RE4 0.8600
346 2M7 0.8598
347 L21 0.8598
348 LR2 0.8596
349 A5H 0.8595
350 HRG 0.8594
351 CCD 0.8593
352 5WK 0.8587
353 FHV 0.8579
354 XDE 0.8578
355 3D8 0.8574
356 HE8 0.8571
357 6HP 0.8569
358 B21 0.8556
359 ZYQ 0.8555
360 5DS 0.8551
361 0NX 0.8545
362 HPT 0.8532
363 P93 0.8529
364 268 0.8526
365 HG3 0.8524
366 RA7 0.8518
367 ZEA 0.8513
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1C3Q; Ligand: TZE; 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: 1c3q.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1C3Q; Ligand: TZE; 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: 1c3q.bio1) has 19 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1C3Q; Ligand: TZE; 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: 1c3q.bio1) has 27 residues
No: Leader PDB Ligand Sequence Similarity
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