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Receptor
PDB id Resolution Class Description Source Keywords
3HGM 1.9 Å NON-ENZYME: OTHER UNIVERSAL STRESS PROTEIN TEAD FROM THE TRAP TRANSPORTER TEAA HALOMONAS ELONGATA HALOMONAS ELONGATA UNIVERSAL STRESS PROTEIN ROSSMANN FOLD SIGNALING PROTEIN
Ref.: STRUCTURE AND FUNCTION OF THE UNIVERSAL STRESS PROT AND ITS ROLE IN REGULATING THE ECTOINE TRANSPORTER HALOMONAS ELONGATA DSM 2581(T) BIOCHEMISTRY V. 49 2194 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ATP A:148;
B:148;
C:148;
D:148;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
Kd = 0.8 uM
507.181 C10 H16 N5 O13 P3 c1nc(...
MG A:149;
B:149;
C:149;
D:149;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3HGM 1.9 Å NON-ENZYME: OTHER UNIVERSAL STRESS PROTEIN TEAD FROM THE TRAP TRANSPORTER TEAA HALOMONAS ELONGATA HALOMONAS ELONGATA UNIVERSAL STRESS PROTEIN ROSSMANN FOLD SIGNALING PROTEIN
Ref.: STRUCTURE AND FUNCTION OF THE UNIVERSAL STRESS PROT AND ITS ROLE IN REGULATING THE ECTOINE TRANSPORTER HALOMONAS ELONGATA DSM 2581(T) BIOCHEMISTRY V. 49 2194 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1443 families.
1 3HGM Kd = 0.8 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1205 families.
1 3HGM Kd = 0.8 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1039 families.
1 3HGM Kd = 0.8 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ATP; Similar ligands found: 422
No: Ligand ECFP6 Tc MDL keys Tc
1 HEJ 1 1
2 ATP 1 1
3 5FA 0.985507 1
4 AQP 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 SAP 0.84 0.945946
12 6YZ 0.833333 0.972222
13 AT4 0.810811 0.958904
14 AN2 0.810811 0.985915
15 25L 0.809524 0.985915
16 AR6 0.802632 0.971831
17 APR 0.802632 0.971831
18 M33 0.8 0.958333
19 ACQ 0.794872 0.972222
20 TAT 0.794872 0.958904
21 T99 0.794872 0.958904
22 AD9 0.792208 0.972222
23 ACP 0.789474 0.972222
24 AMP 0.788732 0.971429
25 A 0.788732 0.971429
26 ANP 0.772152 0.972222
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 PRX 0.734177 0.893333
32 APC 0.734177 0.958904
33 ABM 0.733333 0.917808
34 ATF 0.731707 0.958904
35 ITT 0.730769 0.943662
36 7D4 0.730769 0.905405
37 ADQ 0.729412 0.945205
38 A3R 0.729412 0.907895
39 AP2 0.714286 0.958904
40 A12 0.714286 0.958904
41 A1R 0.709302 0.907895
42 SRA 0.706667 0.918919
43 5AL 0.698795 0.931507
44 HFD 0.695122 0.945946
45 9X8 0.693182 0.92
46 OAD 0.693182 0.945205
47 AU1 0.6875 0.972222
48 SRP 0.682353 0.906667
49 G5P 0.680851 0.921053
50 25A 0.678161 0.971831
51 3OD 0.677778 0.945205
52 4AD 0.670455 0.92
53 G3A 0.670213 0.921053
54 00A 0.662921 0.883117
55 RBY 0.662651 0.932432
56 ADP PO3 0.662651 0.943662
57 ADV 0.662651 0.932432
58 BIS 0.659341 0.933333
59 8QN 0.659091 0.931507
60 5SV 0.659091 0.848101
61 OOB 0.659091 0.931507
62 GTA 0.65625 0.886076
63 UP5 0.653061 0.92
64 AMO 0.651685 0.932432
65 PAJ 0.651685 0.884615
66 2A5 0.650602 0.918919
67 MAP 0.647727 0.945946
68 3AT 0.647059 0.971831
69 AHX 0.644444 0.896104
70 DLL 0.644444 0.931507
71 ATR 0.642857 0.971429
72 PAP 0.642857 0.985714
73 PTJ 0.641304 0.896104
74 7D3 0.6375 0.905405
75 3UK 0.637363 0.918919
76 SON 0.634146 0.932432
77 A4P 0.633663 0.843373
78 ALF ADP 0.632184 0.87013
79 ADP ALF 0.632184 0.87013
80 PR8 0.630435 0.85
81 WAQ 0.630435 0.883117
82 LAD 0.630435 0.860759
83 B5V 0.630435 0.906667
84 AFH 0.628866 0.884615
85 LMS 0.628205 0.82716
86 GAP 0.627907 0.893333
87 DTP 0.627907 0.905405
88 VO4 ADP 0.625 0.931507
89 ADP VO4 0.625 0.931507
90 TXA 0.623656 0.932432
91 ME8 0.623656 0.839506
92 1ZZ 0.623656 0.839506
93 NB8 0.623656 0.896104
94 FYA 0.623656 0.905405
95 DQV 0.622449 0.958333
96 T5A 0.621359 0.841463
97 ADN 0.619718 0.84507
98 RAB 0.619718 0.84507
99 XYA 0.619718 0.84507
100 DAL AMP 0.611111 0.905405
101 9SN 0.610526 0.871795
102 48N 0.61 0.896104
103 AP0 0.607843 0.896104
104 9ZD 0.604396 0.907895
105 9ZA 0.604396 0.907895
106 FA5 0.604167 0.906667
107 B5M 0.604167 0.894737
108 YAP 0.604167 0.894737
109 B5Y 0.604167 0.894737
110 NAI 0.60396 0.907895
111 6V0 0.60396 0.896104
112 TXD 0.60396 0.907895
113 DND 0.60396 0.932432
114 NXX 0.60396 0.932432
115 NAX 0.60396 0.873418
116 ADP BMA 0.602151 0.918919
117 A2R 0.6 0.985915
118 OMR 0.598039 0.851852
119 TXE 0.598039 0.907895
120 XAH 0.597938 0.839506
121 7DT 0.593023 0.985714
122 AOC 0.592593 0.821918
123 4UV 0.591837 0.894737
124 DDS 0.590909 0.878378
125 139 0.590476 0.873418
126 CNA 0.584906 0.932432
127 6AD 0.58427 0.909091
128 5AS 0.583333 0.77907
129 5N5 0.581081 0.819444
130 GA7 0.58 0.906667
131 4UU 0.58 0.894737
132 4TC 0.576923 0.896104
133 ADJ 0.575472 0.851852
134 5CD 0.573333 0.805556
135 A4D 0.573333 0.819444
136 RGT 0.571429 0.958904
137 A3P 0.571429 0.971429
138 7D5 0.56962 0.878378
139 LAQ 0.568627 0.839506
140 F2R 0.564815 0.864198
141 80F 0.563636 0.841463
142 YLP 0.563107 0.819277
143 A A 0.5625 0.944444
144 UPA 0.561905 0.907895
145 AV2 0.56044 0.917808
146 COD 0.559633 0.811765
147 4UW 0.557692 0.860759
148 JB6 0.556701 0.883117
149 3AM 0.555556 0.929577
150 ATP A A A 0.555556 0.930556
151 A2P 0.552941 0.957143
152 TYM 0.552381 0.906667
153 NA7 0.552083 0.958904
154 EP4 0.551282 0.753247
155 MYR AMP 0.55102 0.817073
156 PPS 0.549451 0.873418
157 YLC 0.54717 0.839506
158 YLB 0.54717 0.819277
159 NAD 0.545455 0.931507
160 DAT 0.545455 0.905405
161 TYR AMP 0.544554 0.87013
162 G5A 0.544444 0.77907
163 M2T 0.544304 0.734177
164 DTA 0.544304 0.786667
165 3DH 0.54321 0.773333
166 128 0.542857 0.776471
167 AHZ 0.538462 0.817073
168 GTP 0.537634 0.92
169 SSA 0.537634 0.8
170 MTA 0.5375 0.773333
171 IOT 0.537037 0.831325
172 A3D 0.535714 0.918919
173 ARG AMP 0.533981 0.829268
174 7MD 0.533981 0.8625
175 AR6 AR6 0.533981 0.917808
176 YLA 0.53211 0.819277
177 AMP DBH 0.529412 0.893333
178 IMO 0.529412 0.929577
179 TAD 0.528846 0.884615
180 AYB 0.527273 0.809524
181 A5A 0.526882 0.807229
182 HDV 0.526882 0.893333
183 TSB 0.526316 0.819277
184 EAD 0.525424 0.873418
185 2AM 0.52439 0.943662
186 6RE 0.52381 0.759494
187 7DD 0.522727 0.985714
188 V3L 0.521739 0.971831
189 AVV 0.520833 0.896104
190 BTX 0.517857 0.841463
191 NAE 0.517241 0.894737
192 52H 0.515789 0.77907
193 54H 0.515789 0.788235
194 VMS 0.515789 0.788235
195 NSS 0.515464 0.8
196 BT5 0.513274 0.831325
197 NAQ 0.512821 0.871795
198 ZAS 0.511905 0.766234
199 J7C 0.511628 0.769231
200 A3N 0.511628 0.786667
201 5X8 0.511111 0.763158
202 53H 0.510417 0.77907
203 8X1 0.510417 0.752809
204 5CA 0.510417 0.8
205 NVA LMS 0.510204 0.752809
206 ARU 0.510204 0.860759
207 AF3 ADP 3PG 0.509259 0.8375
208 ZID 0.508475 0.918919
209 P1H 0.508197 0.851852
210 OVE 0.505882 0.905405
211 S4M 0.505747 0.666667
212 LEU LMS 0.50505 0.752809
213 LPA AMP 0.504673 0.817073
214 7MC 0.504587 0.841463
215 DZD 0.5 0.884615
216 FB0 0.5 0.804598
217 MAO 0.5 0.759036
218 DSZ 0.5 0.8
219 LSS 0.5 0.761364
220 DSH 0.5 0.725
221 P5A 0.5 0.744444
222 NDE 0.495935 0.932432
223 N0B 0.495798 0.819277
224 M24 0.495726 0.85
225 YLY 0.495726 0.809524
226 NJP 0.495575 0.945946
227 9K8 0.49505 0.714286
228 MGP 0.494737 0.884615
229 6C6 0.494624 0.881579
230 NAJ PZO 0.491379 0.848101
231 0WD 0.491228 0.921053
232 6G0 0.489583 0.884615
233 GJV 0.488636 0.75
234 6FA 0.488189 0.841463
235 5AD 0.486842 0.746479
236 KAA 0.485149 0.752809
237 GSU 0.485149 0.77907
238 71V 0.483146 0.907895
239 NEC 0.482759 0.746667
240 A3G 0.482759 0.8
241 ODP 0.482456 0.909091
242 FAS 0.48062 0.851852
243 FAD 0.48062 0.851852
244 7D7 0.480519 0.743243
245 FDA 0.480315 0.833333
246 N6P 0.48 0.915493
247 2SA 0.479167 0.932432
248 GP3 0.478723 0.921053
249 4TA 0.478261 0.807229
250 SFG 0.478261 0.75
251 G A A A 0.478261 0.871795
252 AMP NAD 0.478261 0.905405
253 NPW 0.477876 0.886076
254 NDP 0.477876 0.921053
255 NDC 0.47619 0.871795
256 YSA 0.47619 0.77907
257 NAJ PYZ 0.475 0.807229
258 MGO 0.474227 0.860759
259 GDP 0.473684 0.92
260 NZQ 0.473684 0.909091
261 TXP 0.473684 0.921053
262 6IA 0.473684 0.8375
263 A7D 0.472527 0.776316
264 SFD 0.469231 0.734043
265 A5D 0.468085 0.786667
266 SA8 0.468085 0.707317
267 ZDA 0.468085 0.864865
268 12D 0.46789 0.785714
269 PGS 0.467391 0.883117
270 MHZ 0.467391 0.697674
271 8PZ 0.466667 0.8
272 62F 0.466165 0.8625
273 DA 0.465909 0.878378
274 D5M 0.465909 0.878378
275 GGZ 0.464646 0.825
276 SAH 0.463158 0.74359
277 SAI 0.463158 0.734177
278 FAY 0.462687 0.8625
279 Y3J 0.4625 0.726027
280 PO4 PO4 A A A A PO4 0.460784 0.902778
281 AAM 0.460674 0.971429
282 RFL 0.459259 0.821429
283 SMM 0.459184 0.686047
284 HF7 0.459184 0.893333
285 AMZ 0.458824 0.916667
286 C2R 0.458824 0.90411
287 SAM 0.458333 0.690476
288 A3S 0.456522 0.810811
289 FNK 0.455224 0.804598
290 U A 0.453782 0.907895
291 7C5 0.453704 0.818182
292 EEM 0.453608 0.690476
293 AAT 0.453608 0.707317
294 XNP 0.452991 0.873418
295 A G 0.452991 0.883117
296 PRT 0.45283 0.931507
297 AIR 0.451219 0.901408
298 62X 0.45098 0.666667
299 DCA 0.45 0.823529
300 ETB 0.45 0.833333
301 GSP 0.45 0.873418
302 U A G G 0.449153 0.883117
303 NIA 0.448276 0.822785
304 A3T 0.446809 0.821918
305 A A A 0.446602 0.905405
306 K15 0.446602 0.682353
307 PUA 0.446281 0.884615
308 6K6 0.445545 0.930556
309 GEK 0.445545 0.7375
310 4YB 0.445455 0.761364
311 S7M 0.444444 0.690476
312 Z5A 0.443548 0.77907
313 1DG 0.443548 0.921053
314 DG1 0.443548 0.921053
315 0T1 0.442623 0.823529
316 COA 0.442623 0.823529
317 WSA 0.442478 0.788235
318 8BR 0.43956 0.906667
319 8Q2 0.438596 0.772727
320 101 0.438202 0.878378
321 IDP 0.4375 0.918919
322 NVA 2AD 0.4375 0.759494
323 9JJ 0.435714 0.8625
324 NAP 0.435484 0.945205
325 APU 0.434783 0.894737
326 A U 0.434783 0.87013
327 7RP 0.433333 0.928571
328 A6D 0.432692 0.722892
329 AMX 0.432 0.833333
330 J7V 0.432 0.833333
331 TAP 0.432 0.907895
332 COS 0.432 0.804598
333 CAO 0.432 0.795455
334 30N 0.432 0.752688
335 V1N 0.431193 0.917808
336 649 0.429825 0.744444
337 P5F 0.429577 0.823529
338 NA0 0.428571 0.932432
339 SCO 0.428571 0.823529
340 CMX 0.428571 0.823529
341 7RA 0.428571 0.957747
342 0UM 0.427184 0.698795
343 GAV 0.427184 0.884615
344 QQY 0.426966 0.815789
345 1RB 0.426966 0.885714
346 ACK 0.426966 0.861111
347 G1R 0.425743 0.907895
348 GCP 0.425743 0.896104
349 FAM 0.425197 0.804598
350 FCX 0.425197 0.795455
351 ACO 0.425197 0.795455
352 GNH 0.424242 0.907895
353 F2N 0.423611 0.813953
354 GKE 0.422018 0.884615
355 GDD 0.422018 0.884615
356 GDC 0.422018 0.884615
357 HAX 0.421875 0.804598
358 3AD 0.421687 0.805556
359 9GM 0.421569 0.896104
360 GNP 0.421569 0.896104
361 FA9 0.42069 0.864198
362 TM1 0.420561 0.77381
363 KB1 0.420561 0.698795
364 H6Y 0.42 0.945205
365 2MC 0.419847 0.769231
366 3KK 0.418605 0.804598
367 FYN 0.418605 0.823529
368 S8M 0.417476 0.759494
369 7L1 0.417323 0.795455
370 2VA 0.416667 0.8
371 26A 0.416667 0.763158
372 NHD 0.416667 0.905405
373 QQX 0.41573 0.805195
374 CA6 0.415385 0.729167
375 OXK 0.415385 0.804598
376 COK 0.415385 0.804598
377 SOP 0.415385 0.804598
378 MCD 0.415385 0.804598
379 YE1 0.413534 0.813953
380 RMB 0.413043 0.873239
381 FAI 0.413043 0.916667
382 AS 0.413043 0.833333
383 CO6 0.412214 0.804598
384 1VU 0.412214 0.795455
385 CMC 0.412214 0.804598
386 NMX 0.412214 0.76087
387 SXZ 0.411215 0.710843
388 ANZ 0.410714 0.8
389 SCA 0.410448 0.804598
390 CAJ 0.409091 0.804598
391 SCD 0.409091 0.823529
392 EO7 0.408602 0.788235
393 D3Y 0.407767 0.789474
394 CC5 0.407407 0.816901
395 KH3 0.40708 0.674419
396 A C A C 0.406504 0.848101
397 SLU 0.406504 0.770115
398 G 0.40625 0.906667
399 5GP 0.40625 0.906667
400 A1S 0.406015 0.804598
401 IVC 0.406015 0.813953
402 MLC 0.406015 0.804598
403 3HC 0.406015 0.813953
404 1HE 0.406015 0.786517
405 BCO 0.406015 0.804598
406 GTG 0.405405 0.886076
407 NMN AMP PO4 0.404959 0.87013
408 3D1 0.404762 0.773333
409 3L1 0.404762 0.773333
410 2BA 0.404255 0.915493
411 CMP 0.404255 0.901408
412 VRT 0.40404 0.769231
413 SO8 0.40404 0.789474
414 MCA 0.402985 0.795455
415 COO 0.402985 0.804598
416 CAA 0.402985 0.813953
417 3NZ 0.401869 0.782051
418 G2R 0.401869 0.884615
419 ZZB 0.4 0.77381
420 2FA 0.4 0.813333
421 MC4 0.4 0.76087
422 2CP 0.4 0.795455
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3HGM; Ligand: ATP; Similar sites found with APoc: 225
This union binding pocket(no: 1) in the query (biounit: 3hgm.bio2) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 1CT9 AMP None
2 5TWJ SAM None
3 4LAE 1VM None
4 4LAE NAP None
5 5CLO NS8 None
6 3ITJ CIT None
7 3BBH SFG None
8 1OFS SUC None
9 3KC1 2T6 None
10 2BQP GLC None
11 2W9S TOP None
12 1LES GLC FRU None
13 1MID LAP None
14 5ZZO FLC None
15 1ZTH ADP None
16 1F9V ADP None
17 3JUC PCA 1.36054
18 2VVG ADP 1.36054
19 1GOJ ADP 2.04082
20 5XH2 NPO 2.04082
21 3R4S SIA 2.04082
22 3IB1 IMN 2.04082
23 5XQL C2E 2.72109
24 2WSI FAD 2.72109
25 4FK7 P34 2.72109
26 5TH5 MET 2.72109
27 5KJW 53C 2.72109
28 1COY FAD 2.72109
29 2FAV APR 2.72109
30 3RFV NAI 2.72109
31 1COY AND 2.72109
32 1XG5 NAP 2.72109
33 3JYN NDP 2.72109
34 3BJE URA 2.86533
35 6GNO XDI 2.96296
36 2J5V PCA 3.40136
37 5J47 6JJ 3.40136
38 1GET FAD 3.40136
39 1KSK URA 3.40136
40 4HE2 AMP 3.40136
41 1BG2 ADP 3.40136
42 2Y65 ADP 3.40136
43 5L13 6ZE 3.40136
44 3FQ8 PMP 3.40136
45 5V6F MAN BMA MAN 3.62319
46 5A7Y SAH 4.08163
47 1NXJ TLA 4.08163
48 2OQ2 A3P 4.08163
49 2D3S TNR 4.08163
50 2VN9 GVD 4.08163
51 1JJV ATP 4.08163
52 1WXI AMP 4.08163
53 3RHJ NAP 4.08163
54 4ZRN UPG 4.08163
55 4HA9 NDP 4.08163
56 1OC2 NAD 4.08163
57 1OC2 TDX 4.08163
58 1T5C ADP 4.08163
59 1GTE FAD 4.08163
60 4ZRN NAD 4.08163
61 6B5G CQY 4.08163
62 5NUE NAD 4.08163
63 1YQT ADP 4.08163
64 5YV5 ADP 4.08163
65 5L8L ADP 4.2735
66 1Q19 APC 4.7619
67 4FXQ G9L 4.7619
68 4JAL SAH 4.7619
69 1YKJ FAD 4.7619
70 1YKJ PHB 4.7619
71 2IMG MLT 4.7619
72 1V59 NAD 4.7619
73 1MXI SAH 4.7619
74 4M52 FAD 4.7619
75 4JWK CTN 4.7619
76 2A8X FAD 4.7619
77 4RVU NDP 4.7619
78 1U1I NAD 4.7619
79 3EFS BTN 4.7619
80 5IUW NAD 4.7619
81 6MPT C30 4.7619
82 5J60 FAD 4.7619
83 5IUW IAC 4.7619
84 1Q19 SSC 4.7619
85 4RRG A3T 4.96454
86 3NOJ PYR 5.04202
87 5E5U MLI 5.44218
88 5C9P FUC 5.44218
89 5OCG 9R5 5.44218
90 1YKF NAP 5.44218
91 1QH9 LAC 5.44218
92 2BES RES 5.44218
93 2Q8M AMP 5.44218
94 5HVJ ANP 5.44218
95 4HSE ADP 5.44218
96 1LVW TYD 5.44218
97 2IMP NAI 5.44218
98 5ZI9 FLC 5.44218
99 2FJK 13P 5.44218
100 1KEV NDP 5.44218
101 4WOH 4NP 5.44218
102 1ZEM NAD 5.44218
103 3ZF8 GDP 5.44218
104 4RR7 A3S 5.88235
105 3MYZ TFX 6
106 6FA4 D1W 6.12245
107 1VKJ A3P 6.12245
108 5MW4 5JU 6.12245
109 2BO4 FLC 6.12245
110 1KC7 PPR 6.12245
111 1K97 CIR 6.12245
112 1K97 ASP 6.12245
113 4WAS NAP 6.12245
114 4UBP HAE 6.12245
115 5ZJ5 NAI 6.12245
116 5V2J 7WV 6.12245
117 5V2J UDP 6.12245
118 1RHC F42 ACN 6.12245
119 6F5W KG1 6.12245
120 1N9G NAP 6.12245
121 5NM7 GLY 6.39098
122 1KOR SIN 6.75
123 1KOR ARG 6.75
124 1KOR ANP 6.75
125 4CNE SAH 6.80272
126 4YGM URA 6.80272
127 2V2G BEZ 6.80272
128 5VCM UDP 6.80272
129 3QWB NDP 6.80272
130 1KEW TYD 6.80272
131 1KEW NAD 6.80272
132 1IK4 PGH 6.80272
133 1VMK GUN 6.80272
134 4LZB URA 6.80272
135 3GLC R5P 6.80272
136 5H5F SAM 6.80272
137 2YVJ NAI 7.33945
138 5O96 SAM 7.48299
139 1WQ1 AF3 7.48299
140 4B7X NAP 7.48299
141 4CNG SAH 7.48299
142 3G6K POP 7.48299
143 1IYE PGU 7.48299
144 3G6K FAD 7.48299
145 1MVQ MMA 7.48299
146 5U5N NAD 7.48299
147 1DR1 NAP 7.48299
148 1DR1 HBI 7.48299
149 4KVL PLM 8.16327
150 5TVA AMP 8.16327
151 5N5S NAP 8.16327
152 5ZEC NAP 8.16327
153 1ELI PYC 8.16327
154 2CE7 ADP 8.16327
155 3PLS ANP 8.16327
156 1FWV SGA MAG FUC 8.20895
157 3RK1 ATP 8.84354
158 3RK0 AMP 8.84354
159 4UCI ADN 8.84354
160 1Q8V MAN MAN MAN 8.84354
161 2PHX MAN MAN MAN MAN 8.84354
162 2Z49 AMG 8.84354
163 2DFV NAD 8.84354
164 2PHF MAN MAN BMA MAN 8.84354
165 4BQS ADP 8.84354
166 4YMJ 4EJ 8.84354
167 1GPM AMP 9.52381
168 2GAG FOA 9.52381
169 1GPM CIT 9.52381
170 2P3V SRT 9.52381
171 2RAB FAD 9.52381
172 5MUL BDP 9.52381
173 2RAB NAD 9.52381
174 1E6E FAD 10.1562
175 1GVF PGH 10.2041
176 4B4U NAP 10.2041
177 5BWD FUM 10.2041
178 1JGT CMA 10.8844
179 1JGT APC 10.8844
180 6EMU SAM 10.8844
181 5WS9 AMP 10.8844
182 4L80 OXL 10.8844
183 1I1Q TRP 10.8844
184 3ICT FAD 10.8844
185 3ICR FAD 10.8844
186 1V2X SAM 11.5646
187 2V7Q ADP 12.1212
188 5CPR 539 12.2449
189 1S4P GDP 12.2449
190 4RPL FAD 12.2449
191 4RPL 3UC 12.2449
192 1XNG ATP 12.9252
193 4B2D FBP 12.9252
194 3N29 GOL 12.9252
195 1VPE ANP 12.9252
196 4OHB 5HM 13.6054
197 3N9R TD3 13.6054
198 3FIU AMP 14.2857
199 3PD2 A3S 14.2857
200 2RI1 GLP 14.966
201 3NK7 SAM 15.6463
202 3GYQ SAM 15.6463
203 3B9Q MLI 15.6463
204 4IP7 FBP 17.0068
205 5YRV 5AD 17.0068
206 4YSX FAD 17.0068
207 2IYF UDP 17.6871
208 3EWP APR 17.6871
209 1O97 FAD 18.3673
210 1O97 AMP 18.3673
211 1O94 AMP 18.3673
212 2PZ8 APC 18.3673
213 1KQP ADJ 18.3673
214 1RE0 AFB 18.3673
215 2BJK NAD 18.3673
216 3CGB FAD 18.3673
217 6AM8 TRP 19.0476
218 3VZ3 NAP 19.0476
219 4CNK FAD 19.0476
220 1RQL VSO 19.7279
221 2F5Z FAD 21.875
222 4PXL NAD 22.449
223 1EFV FAD 28.5714
224 1EFV AMP 28.5714
225 3EB9 FLC 29.2517
Pocket No.: 2; Query (leader) PDB : 3HGM; Ligand: ATP; Similar sites found with APoc: 75
This union binding pocket(no: 2) in the query (biounit: 3hgm.bio2) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 2BOS GLA GAL GLC NBU None
2 1G6H ADP None
3 5T9F NAP None
4 2VNO GAL GAL FUC None
5 5T9F TYR None
6 6CMJ F6J None
7 5FII PHE None
8 1QAW TRP None
9 2JJK R15 None
10 4U00 ADP 1.36054
11 1R6N 434 1.36054
12 4ZS4 ATP 2.04082
13 2D3N GLC GLC GLC 2.72109
14 2XZ9 PYR 2.72109
15 2W5P CL8 2.72109
16 1YXM ADE 2.72109
17 1GET NAP 3.40136
18 4YAG NAI 3.40136
19 4YKG FAD 3.40136
20 1UNQ 4IP 4
21 1R6D DAU 4.08163
22 4YRY FAD 4.08163
23 1LDN NAD 4.08163
24 1I0B PEL 4.08163
25 1FQK ALF 4.7619
26 2Q0L FAD 4.7619
27 1NAA 6FA 4.7619
28 4J56 FAD 4.7619
29 1WUU GLA 4.7619
30 2VHL GLP 4.7619
31 6FP4 FAD 4.7619
32 1QO8 FAD 4.7619
33 1I1E DM2 4.7619
34 3AYI HCI 4.7619
35 3AYI FAD 4.7619
36 1G8S MET 5.44218
37 4P5E N6P 5.44218
38 3HZT J60 5.44218
39 2IVD FAD 5.44218
40 1P9P SAH 5.44218
41 1T10 F6P 5.44218
42 3KVY URA 6.12245
43 3KIH GDL 6.18557
44 5YZ2 AMP 6.25
45 5A89 FMN 6.80272
46 5A89 ADP 6.80272
47 1R6B ADP 7.48299
48 3ABI NAD 7.48299
49 4JNJ BTN 7.82609
50 3O7B SAH 8.16327
51 1SYN F89 8.16327
52 1GXS BEZ 8.16327
53 1XKQ NDP 8.16327
54 2GNB MAN 8.84354
55 1OVD ORO 8.84354
56 1OVD FMN 8.84354
57 2GN3 MMA 8.84354
58 1Q8O MAN MMA 8.84354
59 1KOL NAD 8.84354
60 4YSW URC 9.52381
61 4JDR FAD 10.2041
62 3RNM FAD 10.2041
63 3B8I OXL 10.8844
64 3AB4 THR 10.8844
65 2CVQ NDP 10.8844
66 2ZB3 NDP 11.5646
67 1JT2 FER 12.9252
68 4CQM NAP 12.9252
69 6HOY TSN 18.3673
70 1BXG HCI 21.7687
71 3K5I AIR 22.449
72 1XF1 CIT 23.8095
73 1B0U ATP 25.1701
74 3LGS ADE 30.6122
75 1WAP TRP 32
Pocket No.: 3; Query (leader) PDB : 3HGM; Ligand: ATP; Similar sites found with APoc: 40
This union binding pocket(no: 3) in the query (biounit: 3hgm.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 1C4Q GLA GAL BGC None
2 4AUT FAD 2.72109
3 1RL4 BRR 3.40136
4 5XHA FRU 3.40136
5 5A1S FLC 4.08163
6 1R6D NAD 4.08163
7 4YRY NAD 4.08163
8 2B5W NAP 4.08163
9 5XXH E0D 4.51128
10 5LQ8 GB 4.7619
11 3LAD FAD 4.7619
12 4Z24 FAD 4.7619
13 5FUI APY 5.30303
14 3UOY FAD 5.44218
15 3UOY NAP 5.44218
16 2JFQ DGL 5.44218
17 4AT0 FAD 6.12245
18 4WAS COO 6.12245
19 5DEP UD1 6.12245
20 1PZG A3D 7.48299
21 2JK0 ASP 7.48299
22 2PTZ PAH 7.48299
23 1T0S BML 8.13953
24 2HQM FAD 8.16327
25 6DIO CIT 8.16327
26 5BSH PRO 8.84354
27 5X2N ALA 8.84354
28 2PHR MAN MAN BMA MAN 8.84354
29 2GMM MAN MAN 8.84354
30 1T3D CYS 8.84354
31 4C1K PEP 9.52381
32 5VJE GOS 9.52381
33 3V8S 0HD 10.2041
34 1AOE GW3 11.5646
35 1AOE NDP 11.5646
36 1SOW NAD 12.9252
37 2C29 NAP 15.6463
38 5G5G MCN 16.3265
39 6HKE LMR 16.3265
40 1BYG STU 17.0068
Pocket No.: 4; Query (leader) PDB : 3HGM; Ligand: ATP; Similar sites found with APoc: 23
This union binding pocket(no: 4) in the query (biounit: 3hgm.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 6GAS FAD None
2 3EWR APR None
3 1V3S ATP None
4 1PVN MZP 2.04082
5 4YKG NAD 3.40136
6 2BKX F6R 3.40136
7 4Z87 5GP 3.40136
8 5ZI2 ADP 4.08163
9 2VSS V55 4.08163
10 1US5 GLU 4.08163
11 4M52 M52 4.7619
12 4UOX PLP 5.44218
13 1UWK NAD 6.12245
14 1UWK URO 6.12245
15 4ME6 ADP 6.80272
16 1GV0 NAD 6.80272
17 1G51 AMP 7.48299
18 3T7S SAM 7.48299
19 2F5X ASP 7.48299
20 2GND MAN 8.84354
21 2PHT MAN MAN MAN BMA MAN 8.84354
22 6HKE MLT 16.3265
23 4Y8D 49J 20.4082
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