Receptor
PDB id Resolution Class Description Source Keywords
2TOH 2.3 Å EC: 1.14.16.2 TYROSINE HYDROXYLASE CATALYTIC AND TETRAMERIZATION DOMAINS F RATTUS NORVEGICUS HYDROXYLASE NEUROTRANSMITTER BIOSYNTHESIS NON-HEME IRON PSUBSTRATE CATECHOLAMINE BIOSYNTHESIS OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF TYROSINE HYDROXYLASE WITH BOUN COFACTOR ANALOGUE AND IRON AT 2.3 A RESOLUTION: SELF-HYDROXYLATION OF PHE300 AND THE PTERIN-BINDING BIOCHEMISTRY V. 37 13437 1998
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:510;
Invalid;
none;
submit data
35.453 Cl [Cl-]
FE A:501;
Part of Protein;
none;
submit data
55.845 Fe [Fe+3...
HBI A:500;
Valid;
none;
Ki = 70 uM
239.231 C9 H13 N5 O3 C[C@@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2TOH 2.3 Å EC: 1.14.16.2 TYROSINE HYDROXYLASE CATALYTIC AND TETRAMERIZATION DOMAINS F RATTUS NORVEGICUS HYDROXYLASE NEUROTRANSMITTER BIOSYNTHESIS NON-HEME IRON PSUBSTRATE CATECHOLAMINE BIOSYNTHESIS OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF TYROSINE HYDROXYLASE WITH BOUN COFACTOR ANALOGUE AND IRON AT 2.3 A RESOLUTION: SELF-HYDROXYLATION OF PHE300 AND THE PTERIN-BINDING BIOCHEMISTRY V. 37 13437 1998
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2TOH Ki = 70 uM HBI C9 H13 N5 O3 C[C@@H]([C....
70% Homology Family (19)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1TG2 - H2B C9 H13 N5 O3 C[C@@H]([C....
2 1J8U - H4B C9 H15 N5 O3 C[C@@H]([C....
3 1MMT - H4B C9 H15 N5 O3 C[C@@H]([C....
4 1LRM - HBI C9 H13 N5 O3 C[C@@H]([C....
5 1DMW - HBI C9 H13 N5 O3 C[C@@H]([C....
6 1KW0 - H4B C9 H15 N5 O3 C[C@@H]([C....
7 6PAH - DAH C9 H11 N O4 c1cc(c(cc1....
8 1MMK - H4B C9 H15 N5 O3 C[C@@H]([C....
9 5PAH - LDP C8 H11 N O2 c1cc(c(cc1....
10 4ANP Ki = 200 uM 3QI C14 H13 N3 O S2 Cc1ccnc(c1....
11 3PAH - XDE C9 H13 N O3 CNC[C@H](c....
12 4PAH - LNR C8 H11 N O3 c1cc(c(cc1....
13 3HF6 ic50 = 0.026 uM LX0 C24 H24 N6 O2 C[C@H](c1c....
14 5TPG ic50 = 14 nM 7H5 C28 H29 Cl F3 N5 O5 S CS(=O)(=O)....
15 3HF8 Ki = 0.31 uM ML0 C27 H22 F4 N4 O3 c1cc(cc(c1....
16 3HFB Ki = 0.03 uM ML4 C27 H26 N4 O2 Cc1ccccc1c....
17 5J6D ic50 = 6 nM 6H5 C30 H35 N5 O5 [H]/N=C(/N....
18 1MLW - HBI C9 H13 N5 O3 C[C@@H]([C....
19 2TOH Ki = 70 uM HBI C9 H13 N5 O3 C[C@@H]([C....
50% Homology Family (20)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1TG2 - H2B C9 H13 N5 O3 C[C@@H]([C....
2 1J8U - H4B C9 H15 N5 O3 C[C@@H]([C....
3 1MMT - H4B C9 H15 N5 O3 C[C@@H]([C....
4 1LRM - HBI C9 H13 N5 O3 C[C@@H]([C....
5 1DMW - HBI C9 H13 N5 O3 C[C@@H]([C....
6 1KW0 - H4B C9 H15 N5 O3 C[C@@H]([C....
7 6PAH - DAH C9 H11 N O4 c1cc(c(cc1....
8 1MMK - H4B C9 H15 N5 O3 C[C@@H]([C....
9 5PAH - LDP C8 H11 N O2 c1cc(c(cc1....
10 4ANP Ki = 200 uM 3QI C14 H13 N3 O S2 Cc1ccnc(c1....
11 3PAH - XDE C9 H13 N O3 CNC[C@H](c....
12 4PAH - LNR C8 H11 N O3 c1cc(c(cc1....
13 3HF6 ic50 = 0.026 uM LX0 C24 H24 N6 O2 C[C@H](c1c....
14 5TPG ic50 = 14 nM 7H5 C28 H29 Cl F3 N5 O5 S CS(=O)(=O)....
15 3HF8 Ki = 0.31 uM ML0 C27 H22 F4 N4 O3 c1cc(cc(c1....
16 3HFB Ki = 0.03 uM ML4 C27 H26 N4 O2 Cc1ccccc1c....
17 5J6D ic50 = 6 nM 6H5 C30 H35 N5 O5 [H]/N=C(/N....
18 1MLW - HBI C9 H13 N5 O3 C[C@@H]([C....
19 5L01 ic50 = 33 nM 6Z4 C27 H27 Cl F3 N5 O3 c1ccc(cc1)....
20 2TOH Ki = 70 uM HBI C9 H13 N5 O3 C[C@@H]([C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: HBI; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 HBI 1 1
2 44W 0.519231 0.816667
3 PH2 0.464286 0.852459
4 ZSP 0.45 1
Similar Ligands (3D)
Ligand no: 1; Ligand: HBI; Similar ligands found: 1139
No: Ligand Similarity coefficient
1 H2B 1.0000
2 H4B 1.0000
3 4AB 0.9981
4 BHS 0.9907
5 7AP 0.9846
6 NEO 0.9782
7 BIO 0.9737
8 0J4 0.9659
9 NEU 0.9657
10 N0Z 0.9603
11 7PJ 0.9596
12 MPU 0.9566
13 HHS 0.9565
14 8Y7 0.9549
15 NPX 0.9548
16 0J5 0.9532
17 2K8 0.9508
18 B52 0.9485
19 B61 0.9468
20 AP6 0.9465
21 KP2 0.9442
22 M78 0.9419
23 NPS 0.9418
24 B56 0.9414
25 Q0K 0.9400
26 GXG 0.9382
27 H4B NO 0.9379
28 RSV 0.9364
29 GO8 0.9352
30 PMM 0.9348
31 DX2 0.9344
32 HHR 0.9334
33 5TY 0.9330
34 92O 0.9325
35 Z25 0.9316
36 YZ9 0.9307
37 FT6 0.9297
38 BGU 0.9289
39 FF2 0.9288
40 S60 0.9288
41 N1E 0.9275
42 T1N 0.9272
43 KF5 0.9266
44 SJK 0.9264
45 ZIP 0.9256
46 3N1 0.9254
47 MS0 0.9252
48 0FK 0.9248
49 ZEC 0.9248
50 1Q4 0.9243
51 5VU 0.9242
52 5V7 0.9241
53 7PS 0.9240
54 3VX 0.9238
55 DBS 0.9237
56 AX4 0.9231
57 N91 0.9230
58 ZEA 0.9230
59 22L 0.9230
60 4NR 0.9229
61 CC5 0.9223
62 8HC 0.9218
63 WS7 0.9215
64 0J2 0.9212
65 EYJ 0.9211
66 CX6 0.9208
67 1BW 0.9205
68 X04 0.9204
69 EV2 0.9202
70 P1J 0.9199
71 2WU 0.9199
72 TCR 0.9198
73 AMR 0.9196
74 W23 0.9194
75 GEN 0.9194
76 WV7 0.9192
77 OA4 0.9191
78 0SY 0.9191
79 AJ1 0.9187
80 5AD 0.9184
81 TRP 0.9184
82 SG2 0.9177
83 1QV 0.9175
84 0OK 0.9175
85 AX5 0.9174
86 AC2 0.9174
87 EYY 0.9173
88 RVE 0.9169
89 D64 0.9167
90 CHQ 0.9165
91 B21 0.9165
92 CG 0.9163
93 OLU 0.9162
94 MPP 0.9162
95 N18 0.9159
96 X0T 0.9155
97 FYR 0.9155
98 5SJ 0.9154
99 AUE 0.9154
100 QIV 0.9154
101 SKF 0.9153
102 2QU 0.9151
103 FQX 0.9151
104 CDY 0.9146
105 STZ 0.9145
106 3SU 0.9144
107 6FB 0.9144
108 5S9 0.9143
109 4Z1 0.9141
110 8DA 0.9133
111 EQA 0.9132
112 OA1 0.9131
113 CTE 0.9129
114 SYE 0.9127
115 S0E 0.9126
116 BQ2 0.9125
117 IQW 0.9124
118 V1T 0.9122
119 68A 0.9121
120 BGN 0.9119
121 0FR 0.9119
122 PIQ 0.9117
123 FNT 0.9116
124 NAL 0.9116
125 JA3 0.9116
126 GJW 0.9115
127 LZ2 0.9115
128 MD6 0.9112
129 K7H 0.9111
130 ZYR 0.9111
131 54X 0.9110
132 EES 0.9108
133 ZYQ 0.9108
134 WUB 0.9106
135 5NN 0.9106
136 FDR 0.9102
137 N2M 0.9098
138 PLP 0.9097
139 2QV 0.9097
140 ZEZ 0.9096
141 S98 0.9096
142 GA2 0.9095
143 HNT 0.9095
144 B5A 0.9094
145 Z17 0.9094
146 FCD 0.9094
147 DTE 0.9093
148 Y3L 0.9092
149 S0G 0.9089
150 HA6 0.9088
151 WS6 0.9088
152 UAY 0.9087
153 9UL 0.9087
154 GZV 0.9086
155 LFN 0.9086
156 AUG 0.9085
157 IL5 0.9085
158 5ER 0.9084
159 PMP 0.9083
160 CUH 0.9079
161 5E5 0.9078
162 G30 0.9078
163 EI1 0.9077
164 YE6 0.9076
165 THA 0.9076
166 PRL 0.9076
167 KMY 0.9071
168 VUP 0.9070
169 EUH 0.9070
170 4KL 0.9070
171 39Z 0.9069
172 7L4 0.9066
173 657 0.9065
174 LTN 0.9065
175 ZHA 0.9065
176 EUE 0.9065
177 0JD 0.9064
178 DE7 0.9063
179 MP5 0.9062
180 2J2 0.9062
181 4I8 0.9061
182 3Y7 0.9061
183 MQG 0.9060
184 30G 0.9059
185 2GQ 0.9057
186 DCF 0.9056
187 5NS 0.9056
188 46M 0.9055
189 E1T 0.9051
190 FY8 0.9049
191 DRG 0.9049
192 E1K 0.9049
193 BVS 0.9048
194 14Z 0.9048
195 BBY 0.9044
196 XCG 0.9043
197 ONZ 0.9040
198 D9Z 0.9039
199 ARP 0.9036
200 JF2 0.9036
201 6DQ 0.9034
202 2FD 0.9032
203 KYN 0.9030
204 3D1 0.9028
205 3L1 0.9028
206 GNG 0.9028
207 4FE 0.9027
208 BG6 0.9026
209 JWS 0.9025
210 MUX 0.9024
211 3GX 0.9023
212 CL9 0.9021
213 3WJ 0.9021
214 XI7 0.9021
215 M9K 0.9020
216 9KZ 0.9019
217 APS 0.9019
218 2PV 0.9019
219 JF8 0.9018
220 TMG 0.9017
221 1ZC 0.9016
222 3AD 0.9015
223 S7G 0.9015
224 MFR 0.9015
225 AJG 0.9015
226 4WF 0.9014
227 3J8 0.9013
228 FT2 0.9013
229 9BF 0.9012
230 ZON 0.9012
231 1DR 0.9012
232 0DF 0.9012
233 8D6 0.9011
234 MDR 0.9010
235 P9E 0.9010
236 0GA 0.9009
237 D8Q 0.9009
238 QME 0.9006
239 YE7 0.9006
240 I2E 0.9006
241 4AU 0.9005
242 ITE 0.9005
243 9DI 0.9004
244 4Z9 0.9004
245 Z21 0.9003
246 GW3 0.9003
247 AVX 0.9003
248 5WT 0.9002
249 G6P 0.9001
250 FSU 0.9001
251 KLV 0.9000
252 WSD 0.9000
253 B41 0.8999
254 DTR 0.8999
255 4BX 0.8998
256 BDI 0.8997
257 PE2 0.8996
258 6L6 0.8995
259 3GC 0.8995
260 2JX 0.8994
261 4EU 0.8994
262 E6Q 0.8993
263 96Z 0.8993
264 47X 0.8993
265 7D7 0.8993
266 5GV 0.8992
267 6MD 0.8990
268 6KT 0.8990
269 9JT 0.8990
270 5XL 0.8988
271 5UD 0.8988
272 ADN 0.8988
273 MUK 0.8988
274 ANC 0.8987
275 1FL 0.8986
276 FCW 0.8985
277 3D8 0.8985
278 4R1 0.8985
279 YF3 0.8984
280 TBN 0.8984
281 7MW 0.8983
282 FM1 0.8983
283 697 0.8982
284 2PK 0.8982
285 2P3 0.8981
286 5F1 0.8980
287 FMB 0.8980
288 D1G 0.8980
289 0HY 0.8979
290 22T 0.8978
291 AD3 0.8978
292 6QF 0.8978
293 FPL 0.8977
294 C53 0.8975
295 9ZE 0.8974
296 BZJ 0.8974
297 GDL 0.8973
298 NPA 0.8973
299 GJK 0.8972
300 Y0V 0.8972
301 IOS 0.8971
302 FC2 0.8971
303 KWB 0.8970
304 XYA 0.8970
305 344 0.8970
306 3AK 0.8969
307 0NJ 0.8969
308 1DA 0.8969
309 M3F 0.8968
310 PLP PMP 0.8968
311 PZP 0.8968
312 537 0.8968
313 5OR 0.8967
314 F5C 0.8965
315 P0P 0.8964
316 5FD 0.8963
317 LUM 0.8963
318 DBM 0.8962
319 WLH 0.8961
320 5N5 0.8961
321 NOS 0.8961
322 15N 0.8961
323 8MO 0.8961
324 A 0.8960
325 9R5 0.8960
326 X0U 0.8960
327 5C1 0.8959
328 LJ4 0.8959
329 1FE 0.8959
330 KTW 0.8959
331 1HR 0.8958
332 ZZZ 0.8958
333 AQN 0.8958
334 3DT 0.8955
335 MJ5 0.8955
336 EXD 0.8955
337 7FU 0.8954
338 363 0.8953
339 JYK 0.8953
340 6HO 0.8953
341 GJP 0.8953
342 JOB 0.8951
343 FER 0.8951
344 NAG 0.8950
345 A4D 0.8950
346 NOC 0.8949
347 ARJ 0.8949
348 SLS 0.8949
349 EYM 0.8949
350 JAK 0.8949
351 7EH 0.8946
352 LP8 0.8945
353 CMU 0.8945
354 ANF 0.8945
355 PLR 0.8944
356 JO5 0.8944
357 5M2 0.8943
358 KWH 0.8943
359 UQ1 0.8943
360 5WK 0.8941
361 JY2 0.8941
362 GXD 0.8941
363 QMS 0.8941
364 NIY 0.8940
365 S8G 0.8940
366 C2M 0.8939
367 A5Q 0.8939
368 4BY 0.8938
369 BNX 0.8937
370 GNY 0.8937
371 6QT 0.8937
372 R4E 0.8936
373 8OX 0.8936
374 JYW 0.8935
375 IXG 0.8935
376 4L2 0.8935
377 ZIQ 0.8933
378 AUV 0.8933
379 H35 0.8931
380 RCV 0.8931
381 EYV 0.8931
382 DXK 0.8930
383 FMC 0.8929
384 5I5 0.8929
385 HRM 0.8928
386 MFZ 0.8926
387 S7D 0.8926
388 DHC 0.8925
389 CEG 0.8925
390 2O6 0.8924
391 EAE 0.8924
392 X48 0.8924
393 Q8G 0.8924
394 2LW 0.8924
395 F40 0.8920
396 GO2 0.8920
397 LVY 0.8920
398 2L2 0.8919
399 ZYV 0.8919
400 M5H 0.8919
401 1CY 0.8919
402 9CE 0.8918
403 JF1 0.8918
404 HRD 0.8917
405 II4 0.8917
406 19E 0.8917
407 L21 0.8916
408 JXK 0.8916
409 M6P 0.8916
410 LL1 0.8915
411 CX4 0.8915
412 1A7 0.8915
413 NIF 0.8914
414 3QV 0.8914
415 3R4 0.8914
416 109 0.8913
417 8NX 0.8912
418 A7H 0.8912
419 549 0.8912
420 3LJ 0.8911
421 IQZ 0.8911
422 78P 0.8910
423 25F 0.8909
424 789 0.8908
425 C93 0.8908
426 HJB 0.8908
427 H75 0.8906
428 54E 0.8906
429 JXT 0.8905
430 PUE 0.8905
431 HH6 0.8905
432 5WS 0.8904
433 ZRL 0.8904
434 NQ7 0.8904
435 2J1 0.8904
436 KW8 0.8904
437 Q8D 0.8903
438 AA 0.8903
439 PRH 0.8901
440 HPR 0.8901
441 2FA 0.8901
442 L07 0.8901
443 YOF 0.8901
444 AZN 0.8901
445 MNS 0.8901
446 428 0.8899
447 2FX 0.8899
448 EF2 0.8899
449 MIL 0.8899
450 PXP 0.8898
451 GLP 0.8898
452 GB4 0.8898
453 E9S 0.8897
454 CK2 0.8897
455 AEY 0.8896
456 2L1 0.8896
457 21D 0.8896
458 DAH 0.8895
459 BC3 0.8894
460 ENG 0.8894
461 BP7 0.8893
462 RE4 0.8892
463 KYA 0.8892
464 535 0.8892
465 EVF 0.8892
466 JYE 0.8891
467 BA5 0.8891
468 1V4 0.8890
469 120 0.8890
470 GNR 0.8889
471 0OO 0.8889
472 2UD 0.8889
473 28A 0.8888
474 2LT 0.8888
475 8M5 0.8887
476 NYJ 0.8886
477 ETV 0.8886
478 57D 0.8886
479 CNI 0.8885
480 X2M 0.8884
481 XFE 0.8884
482 0UL 0.8883
483 M77 0.8883
484 RGK 0.8883
485 6HP 0.8882
486 DT7 0.8882
487 801 0.8882
488 L15 0.8881
489 THM 0.8881
490 26C 0.8881
491 XIF XYP 0.8880
492 XYP XIF 0.8880
493 3F4 0.8880
494 3XH 0.8880
495 7MX 0.8880
496 GMP 0.8880
497 MXD 0.8880
498 ZRK 0.8878
499 FWD 0.8878
500 7EL 0.8878
501 3ZB 0.8878
502 LWS 0.8877
503 SZ5 0.8877
504 J38 0.8877
505 IMH 0.8877
506 NPL 0.8877
507 UNJ 0.8877
508 9FH 0.8877
509 BHQ 0.8877
510 1V3 0.8876
511 6ZW 0.8876
512 UN9 0.8875
513 15Q 0.8875
514 C9M 0.8873
515 Q5M 0.8873
516 49P 0.8873
517 CUQ 0.8873
518 DX6 0.8873
519 A5H 0.8873
520 5MD 0.8872
521 1HN 0.8871
522 GNV 0.8871
523 CIY 0.8871
524 TCC 0.8870
525 DUR 0.8868
526 B86 0.8868
527 3WK 0.8868
528 UA2 0.8867
529 RAB 0.8867
530 1A5 0.8867
531 1EB 0.8866
532 RZH 0.8866
533 TSR 0.8865
534 IAC 0.8865
535 6CR 0.8864
536 CZ0 0.8864
537 4RU 0.8864
538 LI7 0.8863
539 PIC 0.8862
540 TCL 0.8862
541 96U 0.8862
542 PQM 0.8862
543 XIL 0.8860
544 XDL XYP 0.8860
545 5B2 0.8860
546 JA5 0.8859
547 4CN 0.8859
548 FM2 0.8859
549 28N 0.8859
550 5GT 0.8858
551 51Y 0.8858
552 3UG 0.8857
553 9H2 0.8857
554 SNI 0.8857
555 27B 0.8856
556 DCZ 0.8856
557 1HP 0.8856
558 CP6 0.8856
559 NDG 0.8856
560 KW7 0.8855
561 1EL 0.8854
562 848 0.8854
563 BGP 0.8854
564 H5B 0.8854
565 1VK 0.8853
566 1V1 0.8852
567 IS2 0.8852
568 HBO 0.8851
569 PQS 0.8851
570 0LA 0.8850
571 3VQ 0.8850
572 QMR 0.8850
573 M2E 0.8849
574 AWE 0.8849
575 RDT 0.8848
576 MAJ 0.8848
577 K97 0.8847
578 XYP XYP 0.8847
579 M02 0.8846
580 KU1 0.8846
581 3CA 0.8846
582 397 0.8845
583 CR4 0.8844
584 P4L 0.8843
585 5WN 0.8843
586 20D 0.8843
587 JYT 0.8843
588 JAH 0.8843
589 78U 0.8842
590 EEK 0.8842
591 4UO 0.8842
592 ZZA 0.8842
593 THU 0.8842
594 61M 0.8842
595 GI4 0.8841
596 4GU 0.8841
597 PTB 0.8841
598 MCY 0.8841
599 6EL 0.8841
600 78Y 0.8840
601 5VL 0.8839
602 C2Y 0.8839
603 A5P 0.8839
604 8XL 0.8837
605 ESI 0.8837
606 C4E 0.8837
607 TGW 0.8837
608 6Q3 0.8836
609 JBZ 0.8836
610 89J 0.8835
611 96R 0.8835
612 WG8 0.8834
613 7G0 0.8834
614 N8Y 0.8833
615 JCZ 0.8833
616 BMZ 0.8833
617 S0D 0.8832
618 WCU 0.8832
619 A6W 0.8832
620 PQT 0.8832
621 OQC 0.8832
622 4NS 0.8832
623 JOV 0.8831
624 XG1 0.8831
625 Y70 0.8831
626 2KA 0.8831
627 EXG 0.8830
628 DFL 0.8830
629 LZB 0.8829
630 52F 0.8828
631 LOT 0.8828
632 27K 0.8827
633 88R 0.8827
634 JP2 0.8827
635 IOP 0.8824
636 12R 0.8822
637 2KU 0.8822
638 AH6 0.8822
639 PEY 0.8822
640 3VW 0.8822
641 5NE 0.8822
642 HA5 0.8821
643 774 0.8819
644 124 0.8819
645 AP4 0.8819
646 BSA 0.8818
647 BZQ 0.8818
648 D1Y 0.8816
649 UFO 0.8816
650 D2G 0.8816
651 H7S 0.8816
652 8W9 0.8815
653 GHM 0.8815
654 AU8 0.8815
655 DPT 0.8814
656 6J5 0.8814
657 T98 0.8813
658 NLA 0.8813
659 272 0.8813
660 A73 0.8811
661 LR2 0.8811
662 PYU 0.8810
663 A6P 0.8810
664 AVA 0.8807
665 ZAR 0.8807
666 3VS 0.8807
667 5P3 0.8807
668 92G 0.8806
669 3EB 0.8806
670 Q9P 0.8803
671 M3Q 0.8803
672 DNA 0.8800
673 EQU 0.8800
674 ZTW 0.8799
675 KOM 0.8799
676 PTS 0.8798
677 12T 0.8798
678 42R 0.8798
679 TIY 0.8797
680 N4E 0.8797
681 N7I 0.8796
682 MOK 0.8796
683 88X 0.8796
684 CWD 0.8795
685 LLT 0.8795
686 EZL 0.8795
687 GI1 0.8795
688 PZ8 0.8794
689 LZJ 0.8794
690 3BH 0.8794
691 JY4 0.8793
692 3JC 0.8792
693 CDJ 0.8791
694 1AJ 0.8789
695 NK5 0.8789
696 5XK 0.8788
697 B2L 0.8788
698 TYP 0.8788
699 LR8 0.8786
700 4B0 0.8786
701 6P3 0.8785
702 8HG 0.8785
703 VXX 0.8785
704 EE8 0.8784
705 BB4 0.8783
706 6X9 0.8783
707 27M 0.8781
708 OCZ 0.8781
709 SWX 0.8780
710 W29 0.8779
711 EYA 0.8779
712 B2E 0.8778
713 4CF 0.8778
714 KWQ 0.8778
715 OX2 0.8777
716 0DN 0.8777
717 5BT 0.8777
718 26A 0.8776
719 QIF 0.8776
720 NRA 0.8776
721 AOY 0.8775
722 2J5 0.8775
723 NQH 0.8775
724 I4D 0.8775
725 EST 0.8775
726 IPD 0.8774
727 GC2 0.8774
728 092 0.8773
729 DNQ 0.8773
730 BPY 0.8773
731 V13 0.8772
732 SQV 0.8772
733 ELH 0.8772
734 36M 0.8771
735 1SF 0.8771
736 AN3 0.8771
737 795 0.8771
738 PRF 0.8771
739 M01 0.8770
740 VC3 0.8770
741 ZME 0.8770
742 NDD 0.8768
743 BWD 0.8768
744 NKI 0.8766
745 3IP 0.8766
746 P4T 0.8766
747 CP7 0.8765
748 1QP 0.8764
749 M6D 0.8764
750 VT3 0.8763
751 M3W 0.8763
752 EGR 0.8763
753 CPW 0.8763
754 CU8 0.8763
755 ENO 0.8762
756 ESX 0.8761
757 HVE 0.8760
758 JRO 0.8760
759 0OL 0.8760
760 536 0.8759
761 5NB 0.8759
762 92P 0.8759
763 AJY 0.8758
764 FMQ 0.8758
765 KJ5 0.8758
766 L2K 0.8757
767 XYP XDN 0.8757
768 ALE 0.8756
769 MUR 0.8756
770 MTP 0.8755
771 9FE 0.8755
772 SQM 0.8755
773 3WN 0.8754
774 3WO 0.8754
775 38B 0.8754
776 DBE 0.8754
777 555 0.8753
778 6WL 0.8753
779 DDU 0.8753
780 5F5 0.8753
781 5TZ 0.8752
782 S7V 0.8751
783 1XS 0.8751
784 F01 0.8750
785 CKA 0.8749
786 LZ5 0.8748
787 D3G 0.8748
788 9TF 0.8748
789 AZM 0.8748
790 A05 0.8746
791 PVQ 0.8746
792 1OT 0.8746
793 4UM 0.8745
794 ODK 0.8743
795 EV3 0.8743
796 G1P 0.8743
797 P2L 0.8742
798 CUT 0.8741
799 LDC 0.8740
800 JTF 0.8740
801 6SD 0.8740
802 CUE 0.8740
803 5ID 0.8739
804 L03 0.8739
805 IQ5 0.8739
806 6E8 0.8739
807 3QI 0.8738
808 QNM 0.8738
809 RPP 0.8737
810 PF1 0.8737
811 2AX 0.8737
812 KMP 0.8737
813 MNP 0.8737
814 1F1 0.8736
815 K68 0.8736
816 HO6 0.8736
817 GVY 0.8735
818 JGB 0.8735
819 OUB 0.8734
820 PVK 0.8734
821 D87 0.8734
822 XRS 0.8734
823 RKN 0.8733
824 TXW 0.8732
825 I59 0.8730
826 H70 0.8730
827 833 0.8730
828 5XM 0.8730
829 MMS 0.8729
830 QH3 0.8729
831 4MP 0.8728
832 AJ4 0.8728
833 MI2 0.8727
834 AZC 0.8727
835 56N 0.8726
836 HFT 0.8725
837 KCH 0.8724
838 64E 0.8723
839 CX5 0.8723
840 GOE 0.8723
841 CLZ 0.8723
842 4NP 0.8722
843 L3L 0.8721
844 9GP 0.8721
845 GB5 0.8721
846 UL1 0.8721
847 L1T 0.8721
848 GNJ 0.8721
849 M4E 0.8721
850 C0W 0.8720
851 JTA 0.8720
852 TIA 0.8720
853 KLK 0.8720
854 5CD 0.8719
855 NWD 0.8718
856 J1K 0.8718
857 IDD 0.8717
858 JVQ 0.8717
859 5RO 0.8717
860 LJ3 0.8717
861 CGW 0.8716
862 DBQ 0.8715
863 GNM 0.8715
864 CR1 0.8714
865 GFE 0.8714
866 2D2 0.8714
867 MQB 0.8712
868 FTV 0.8712
869 H2W 0.8711
870 CH9 0.8711
871 9FG 0.8711
872 W8L 0.8710
873 0LO 0.8710
874 NVU 0.8710
875 D6G 0.8708
876 GJB 0.8706
877 IQP 0.8705
878 LNR 0.8705
879 M6Z 0.8704
880 EMO 0.8704
881 CFA 0.8703
882 N2I 0.8703
883 QR2 0.8703
884 YIH 0.8702
885 PNP 0.8702
886 6NI 0.8702
887 RUG 0.8701
888 CBE 0.8701
889 5WU 0.8700
890 PJW 0.8700
891 IWD 0.8699
892 X6P 0.8699
893 AH9 0.8699
894 9OF 0.8699
895 S7S 0.8699
896 372 0.8699
897 TYR 0.8698
898 LIP 0.8697
899 ADL 0.8697
900 6JO 0.8697
901 3RP 0.8696
902 9E3 0.8696
903 V2Z 0.8696
904 LO1 0.8696
905 JDN 0.8696
906 9FL 0.8696
907 SX3 0.8696
908 44V 0.8695
909 6ME 0.8695
910 BVA 0.8695
911 A4V 0.8694
912 EQW 0.8694
913 8EQ 0.8694
914 0OY 0.8693
915 2LY 0.8693
916 CSN 0.8692
917 6DH 0.8691
918 TQ3 0.8691
919 0RY 0.8690
920 CLI 0.8690
921 7I2 0.8690
922 4ZF 0.8690
923 5LA 0.8690
924 3WL 0.8689
925 YO5 0.8689
926 ICB 0.8689
927 AGI 0.8688
928 ESP 0.8687
929 QX4 0.8687
930 EN1 0.8686
931 FHC 0.8686
932 KLS 0.8686
933 A2G 0.8685
934 DQU 0.8685
935 8G6 0.8685
936 H4E 0.8684
937 9LI 0.8684
938 DNF 0.8683
939 TB8 0.8682
940 4BL 0.8682
941 11X 0.8681
942 B0K 0.8680
943 A4N 0.8679
944 SNB 0.8678
945 C9E 0.8677
946 5OO 0.8677
947 JB8 0.8677
948 S8A 0.8677
949 68B 0.8677
950 GI3 0.8677
951 ID2 0.8676
952 TI7 0.8676
953 FZM 0.8674
954 NQ8 0.8674
955 MTH 0.8673
956 XTS 0.8673
957 NIR 0.8672
958 TMC 0.8672
959 531 0.8671
960 A9B 0.8671
961 RVD 0.8669
962 MTA 0.8668
963 NTF 0.8668
964 4VS 0.8668
965 67Y 0.8667
966 BIH 0.8666
967 H52 0.8666
968 F4U 0.8665
969 64F 0.8665
970 S46 0.8665
971 CC6 0.8665
972 3A9 0.8663
973 5TT 0.8662
974 BIE 0.8662
975 STT 0.8662
976 LDR 0.8661
977 CTN 0.8661
978 5O6 0.8660
979 SNV 0.8660
980 BJ4 0.8659
981 AJD 0.8659
982 TID 0.8659
983 1KX 0.8657
984 XYS XYP 0.8656
985 NXB 0.8654
986 QBP 0.8654
987 WDW 0.8653
988 94W 0.8653
989 AAN 0.8652
990 B23 0.8651
991 E7S 0.8651
992 GRX 0.8650
993 LEL 0.8650
994 X11 0.8650
995 7QV 0.8649
996 BHM 0.8649
997 PPN 0.8648
998 0K7 0.8648
999 GJG 0.8647
1000 4FF 0.8647
1001 27F 0.8646
1002 ALX 0.8645
1003 TR4 0.8645
1004 VM1 0.8643
1005 8ZE 0.8642
1006 MG7 0.8641
1007 U7E 0.8641
1008 IXM 0.8640
1009 GZ2 0.8639
1010 E3X 0.8639
1011 JXW 0.8638
1012 6VD 0.8638
1013 J27 0.8638
1014 0HN 0.8637
1015 SRO 0.8637
1016 WOE 0.8636
1017 1IT 0.8635
1018 9CA 0.8635
1019 HMD 0.8635
1020 613 0.8634
1021 Q9T 0.8634
1022 2JK 0.8634
1023 041 0.8633
1024 8U3 0.8633
1025 L22 0.8632
1026 ST1 0.8632
1027 6J9 0.8632
1028 0FO 0.8632
1029 B62 0.8630
1030 G14 0.8630
1031 MW5 0.8628
1032 0HO 0.8628
1033 JTH 0.8628
1034 TQU 0.8628
1035 4I5 0.8627
1036 JAW 0.8625
1037 YTX 0.8624
1038 CXH 0.8624
1039 4MB 0.8623
1040 6BK 0.8623
1041 GT1 0.8622
1042 K25 0.8622
1043 ST3 0.8621
1044 EAT 0.8620
1045 JFS 0.8620
1046 5F8 0.8620
1047 XYP XYS 0.8619
1048 0NX 0.8619
1049 DHY 0.8618
1050 8NB 0.8617
1051 7R7 0.8616
1052 8GK 0.8616
1053 HWD 0.8614
1054 B4O 0.8613
1055 F4K 0.8613
1056 HC4 0.8611
1057 IA2 0.8611
1058 ALR 0.8611
1059 9AP 0.8610
1060 A4T 0.8610
1061 3TV 0.8609
1062 JG8 0.8608
1063 878 0.8608
1064 57O 0.8607
1065 R9Y 0.8605
1066 DT9 0.8605
1067 GL6 0.8604
1068 8UY 0.8604
1069 6NZ 0.8602
1070 GAL FUC 0.8601
1071 2FQ 0.8600
1072 ERZ 0.8600
1073 ABF 0.8599
1074 NWW 0.8599
1075 BZ2 0.8599
1076 0QA 0.8598
1077 MPK 0.8598
1078 K48 0.8596
1079 K82 0.8596
1080 NGA 0.8595
1081 M83 0.8595
1082 36E 0.8595
1083 N2Y 0.8594
1084 8CC 0.8593
1085 E35 0.8591
1086 MVN 0.8591
1087 J6W 0.8589
1088 7CT 0.8588
1089 NE2 0.8587
1090 MTS 0.8587
1091 C0H 0.8586
1092 TRU 0.8586
1093 6NT 0.8586
1094 XEN 0.8585
1095 SCT 0.8584
1096 TSS 0.8582
1097 K44 0.8581
1098 A8D 0.8580
1099 6MW 0.8580
1100 PQZ 0.8579
1101 A9K 0.8577
1102 PCQ 0.8575
1103 BPU 0.8575
1104 244 0.8574
1105 5FL 0.8572
1106 XHP 0.8572
1107 5NI 0.8572
1108 2ZM 0.8571
1109 6DP 0.8569
1110 55D 0.8568
1111 HKD 0.8562
1112 PPY 0.8562
1113 ISC 0.8560
1114 URI 0.8559
1115 SDN 0.8559
1116 MTI 0.8555
1117 U13 0.8555
1118 4NO 0.8550
1119 L46 0.8547
1120 NCV 0.8545
1121 NAR 0.8544
1122 2DL 0.8544
1123 5OF 0.8543
1124 7BX 0.8542
1125 RH1 0.8539
1126 JND 0.8537
1127 DX1 0.8537
1128 LVE 0.8537
1129 2AN 0.8536
1130 54Z 0.8533
1131 OTW 0.8531
1132 L5D 0.8531
1133 NBG 0.8528
1134 ASD 0.8522
1135 BBK 0.8522
1136 F18 0.8513
1137 BK9 0.8513
1138 IBM 0.8511
1139 6J3 0.8507
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2TOH; Ligand: HBI; 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: 2toh.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2TOH; Ligand: HBI; 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: 2toh.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 2TOH; Ligand: HBI; 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: 2toh.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 2TOH; Ligand: HBI; 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: 2toh.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
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