Receptor
PDB id Resolution Class Description Source Keywords
4USI 1.45 Å NON-ENZYME: OTHER NITROGEN REGULATORY PROTEIN PII FROM CHLAMYDOMONAS REINHARDTII IN COMPLEX WITH MGATP AND 2-OXOGLUTARATE CHLAMYDOMONAS REINHARDTII SIGNALING PROTEIN
Ref.: A WIDESPREAD GLUTAMINE-SENSING MECHANISM IN THE PLA KINGDOM. CELL(CAMBRIDGE,MASS.) V. 159 1188 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:1151;
B:1151;
Part of Protein;
Part of Protein;
none;
none;
submit data
24.305 Mg [Mg+2...
SO4 C:1152;
Invalid;
none;
submit data
96.063 O4 S [O-]S...
ATP A:1152;
B:1152;
Valid;
Valid;
none;
none;
submit data
507.181 C10 H16 N5 O13 P3 c1nc(...
AKG B:1153;
A:1153;
Valid;
Valid;
none;
none;
ic50 = 1.18 mM
146.098 C5 H6 O5 C(CC(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4USI 1.45 Å NON-ENZYME: OTHER NITROGEN REGULATORY PROTEIN PII FROM CHLAMYDOMONAS REINHARDTII IN COMPLEX WITH MGATP AND 2-OXOGLUTARATE CHLAMYDOMONAS REINHARDTII SIGNALING PROTEIN
Ref.: A WIDESPREAD GLUTAMINE-SENSING MECHANISM IN THE PLA KINGDOM. CELL(CAMBRIDGE,MASS.) V. 159 1188 2014
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 4USI ic50 = 1.18 mM AKG C5 H6 O5 C(CC(=O)O)....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1068 families.
1 4USI ic50 = 1.18 mM AKG C5 H6 O5 C(CC(=O)O)....
50% Homology Family (28)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 922 families.
1 4CO0 Kd = 20 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
2 4CO4 Kd = 2 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
3 4CO3 Kd = 2 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
4 3MHY - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
5 4CO2 Kd = 20 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
6 4CO1 Kd = 20 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
7 4CNZ Kd = 20 uM ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
8 2O66 - FLC C6 H5 O7 C(C(=O)[O-....
9 2O67 - MLI C3 H2 O4 C(C(=O)[O-....
10 3TA1 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
11 3TA0 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
12 3TA2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
13 2GNK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
14 3LF0 Kd = 1.93 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
15 3NCR - ADP MG n/a n/a
16 3NCQ - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
17 4OZL - AMP C10 H14 N5 O7 P c1nc(c2c(n....
18 4OZJ - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
19 2J9C - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
20 2J9E - AKG C5 H6 O5 C(CC(=O)O)....
21 4USI ic50 = 1.18 mM AKG C5 H6 O5 C(CC(=O)O)....
22 5L9N - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
23 1V3S - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
24 1V9O - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
25 2XBP Kd = 9.6 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
26 2XZW - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
27 4AFF - FLC C6 H5 O7 C(C(=O)[O-....
28 2XUL - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ATP; Similar ligands found: 404
No: Ligand ECFP6 Tc MDL keys Tc
1 ATP 1 1
2 AQP 0.985507 1
3 5FA 0.985507 1
4 B4P 0.927536 0.971831
5 AP5 0.927536 0.971831
6 BA3 0.913043 0.971831
7 ADP 0.9 1
8 A2D 0.884058 0.971831
9 SAP 0.84 0.945946
10 AGS 0.84 0.945946
11 AN2 0.810811 0.985915
12 25L 0.809524 0.985915
13 APR 0.802632 0.971831
14 AR6 0.802632 0.971831
15 M33 0.8 0.958333
16 TAT 0.794872 0.958904
17 ACQ 0.794872 0.972222
18 AD9 0.792208 0.972222
19 ACP 0.789474 0.972222
20 A 0.788732 0.971429
21 AMP 0.788732 0.971429
22 ANP 0.772152 0.972222
23 ADX 0.753247 0.873418
24 CA0 0.753247 0.945205
25 A22 0.746988 0.985915
26 50T 0.74359 0.958333
27 APC 0.734177 0.958904
28 PRX 0.734177 0.893333
29 ABM 0.733333 0.917808
30 ATF 0.731707 0.958904
31 ITT 0.730769 0.943662
32 7D4 0.730769 0.905405
33 ADQ 0.729412 0.945205
34 AMP MG 0.72 0.891892
35 AP2 0.714286 0.958904
36 A12 0.714286 0.958904
37 A1R 0.709302 0.907895
38 SRA 0.706667 0.918919
39 5AL 0.698795 0.931507
40 OAD 0.693182 0.945205
41 ADP MG 0.6875 0.905405
42 AU1 0.6875 0.972222
43 SRP 0.682353 0.906667
44 G5P 0.680851 0.921053
45 BEF ADP 0.679012 0.881579
46 ADP BEF 0.679012 0.881579
47 25A 0.678161 0.971831
48 3OD 0.677778 0.945205
49 4AD 0.670455 0.92
50 G3A 0.670213 0.921053
51 00A 0.662921 0.883117
52 ADV 0.662651 0.932432
53 ADP PO3 0.662651 0.943662
54 RBY 0.662651 0.932432
55 BIS 0.659341 0.933333
56 5SV 0.659091 0.848101
57 8QN 0.659091 0.931507
58 OOB 0.659091 0.931507
59 GTA 0.65625 0.886076
60 ATP MG 0.654762 0.905405
61 UP5 0.653061 0.92
62 AMO 0.651685 0.932432
63 PAJ 0.651685 0.884615
64 2A5 0.650602 0.918919
65 MAP 0.647727 0.945946
66 3AT 0.647059 0.971831
67 AHX 0.644444 0.896104
68 DLL 0.644444 0.931507
69 PAP 0.642857 0.985714
70 ATR 0.642857 0.971429
71 PTJ 0.641304 0.896104
72 7D3 0.6375 0.905405
73 3UK 0.637363 0.918919
74 SON 0.634146 0.932432
75 A4P 0.633663 0.843373
76 ALF ADP 0.632184 0.87013
77 ADP ALF 0.632184 0.87013
78 LAD 0.630435 0.860759
79 WAQ 0.630435 0.883117
80 PR8 0.630435 0.85
81 AFH 0.628866 0.884615
82 DTP 0.627907 0.905405
83 GAP 0.627907 0.893333
84 ANP MG 0.625 0.894737
85 VO4 ADP 0.625 0.931507
86 ADP VO4 0.625 0.931507
87 1ZZ 0.623656 0.839506
88 TXA 0.623656 0.932432
89 FYA 0.623656 0.905405
90 ME8 0.623656 0.839506
91 NB8 0.623656 0.896104
92 T5A 0.621359 0.841463
93 RAB 0.619718 0.84507
94 ADN 0.619718 0.84507
95 XYA 0.619718 0.84507
96 9SN 0.610526 0.871795
97 48N 0.61 0.896104
98 AP0 0.607843 0.896104
99 FA5 0.604167 0.906667
100 YAP 0.604167 0.894737
101 TXD 0.60396 0.907895
102 6V0 0.60396 0.896104
103 NXX 0.60396 0.932432
104 NAI 0.60396 0.907895
105 DND 0.60396 0.932432
106 NAX 0.60396 0.873418
107 ADP BMA 0.602151 0.918919
108 A2R 0.6 0.985915
109 OMR 0.598039 0.851852
110 TXE 0.598039 0.907895
111 XAH 0.597938 0.839506
112 DAL AMP 0.593407 0.905405
113 7DT 0.593023 0.985714
114 AOC 0.592593 0.821918
115 4UV 0.591837 0.894737
116 DDS 0.590909 0.878378
117 139 0.590476 0.873418
118 CNA 0.584906 0.932432
119 6AD 0.58427 0.909091
120 5AS 0.583333 0.77907
121 5N5 0.581081 0.819444
122 4UU 0.58 0.894737
123 4TC 0.576923 0.896104
124 ADJ 0.575472 0.851852
125 5CD 0.573333 0.805556
126 A4D 0.573333 0.819444
127 RGT 0.571429 0.958904
128 A3P 0.571429 0.971429
129 7D5 0.56962 0.878378
130 LAQ 0.568627 0.839506
131 YLP 0.563107 0.819277
132 A A 0.5625 0.944444
133 UPA 0.561905 0.907895
134 AV2 0.56044 0.917808
135 COD 0.559633 0.811765
136 4UW 0.557692 0.860759
137 JB6 0.556701 0.883117
138 3AM 0.555556 0.929577
139 ATP A A A 0.555556 0.930556
140 A2P 0.552941 0.957143
141 TYM 0.552381 0.906667
142 NA7 0.552083 0.958904
143 EP4 0.551282 0.753247
144 MYR AMP 0.55102 0.817073
145 PPS 0.549451 0.873418
146 YLB 0.54717 0.819277
147 YLC 0.54717 0.839506
148 NAD 0.545455 0.931507
149 DAT 0.545455 0.905405
150 G5A 0.544444 0.77907
151 M2T 0.544304 0.734177
152 DTA 0.544304 0.786667
153 3DH 0.54321 0.773333
154 128 0.542857 0.776471
155 AHZ 0.538462 0.817073
156 SSA 0.537634 0.8
157 GTP 0.537634 0.92
158 MTA 0.5375 0.773333
159 IOT 0.537037 0.831325
160 A3D 0.535714 0.918919
161 TYR AMP 0.534653 0.881579
162 AR6 AR6 0.533981 0.917808
163 7MD 0.533981 0.8625
164 YLA 0.53211 0.819277
165 AMP DBH 0.529412 0.893333
166 IMO 0.529412 0.929577
167 TAD 0.528846 0.884615
168 AYB 0.527273 0.809524
169 A5A 0.526882 0.807229
170 TSB 0.526316 0.819277
171 EAD 0.525424 0.873418
172 2AM 0.52439 0.943662
173 6RE 0.52381 0.759494
174 7DD 0.522727 0.985714
175 V3L 0.521739 0.971831
176 AVV 0.520833 0.896104
177 BTX 0.517857 0.841463
178 NAE 0.517241 0.894737
179 54H 0.515789 0.788235
180 VMS 0.515789 0.788235
181 52H 0.515789 0.77907
182 NSS 0.515464 0.8
183 BT5 0.513274 0.831325
184 NAQ 0.512821 0.871795
185 ZAS 0.511905 0.766234
186 A3N 0.511628 0.786667
187 J7C 0.511628 0.769231
188 5X8 0.511111 0.763158
189 53H 0.510417 0.77907
190 5CA 0.510417 0.8
191 ARU 0.510204 0.860759
192 ARG AMP 0.509434 0.829268
193 AF3 ADP 3PG 0.509259 0.8375
194 LA8 ALF 3PG 0.509259 0.8375
195 ALF ADP 3PG 0.509259 0.8375
196 ZID 0.508475 0.918919
197 P1H 0.508197 0.851852
198 OVE 0.505882 0.905405
199 S4M 0.505747 0.666667
200 LPA AMP 0.504673 0.817073
201 7MC 0.504587 0.841463
202 DZD 0.5 0.884615
203 LSS 0.5 0.761364
204 DSZ 0.5 0.8
205 P5A 0.5 0.744444
206 DSH 0.5 0.725
207 FB0 0.5 0.804598
208 MAO 0.5 0.759036
209 NDE 0.495935 0.932432
210 N0B 0.495798 0.819277
211 M24 0.495726 0.85
212 YLY 0.495726 0.809524
213 NJP 0.495575 0.945946
214 NVA LMS 0.494949 0.761364
215 MGP 0.494737 0.884615
216 6C6 0.494624 0.881579
217 NAJ PZO 0.491379 0.848101
218 0WD 0.491228 0.921053
219 LEU LMS 0.49 0.761364
220 6G0 0.489583 0.884615
221 GJV 0.488636 0.75
222 6FA 0.488189 0.841463
223 5AD 0.486842 0.746479
224 GSU 0.485149 0.77907
225 KAA 0.485149 0.752809
226 71V 0.483146 0.907895
227 NEC 0.482759 0.746667
228 A3G 0.482759 0.8
229 NAD IBO 0.482456 0.87013
230 ODP 0.482456 0.909091
231 FAS 0.48062 0.851852
232 FAD 0.48062 0.851852
233 7D7 0.480519 0.743243
234 FDA 0.480315 0.833333
235 N6P 0.48 0.915493
236 2SA 0.479167 0.932432
237 GP3 0.478723 0.921053
238 4TA 0.478261 0.807229
239 G A A A 0.478261 0.871795
240 SFG 0.478261 0.75
241 NPW 0.477876 0.886076
242 NDP 0.477876 0.921053
243 NDC 0.47619 0.871795
244 YSA 0.47619 0.77907
245 MGO 0.474227 0.860759
246 6IA 0.473684 0.8375
247 TXP 0.473684 0.921053
248 GDP 0.473684 0.92
249 NZQ 0.473684 0.909091
250 A7D 0.472527 0.776316
251 SFD 0.469231 0.734043
252 ZDA 0.468085 0.864865
253 SA8 0.468085 0.707317
254 A5D 0.468085 0.786667
255 12D 0.46789 0.785714
256 PGS 0.467391 0.883117
257 MHZ 0.467391 0.697674
258 62F 0.466165 0.8625
259 DA 0.465909 0.878378
260 D5M 0.465909 0.878378
261 GGZ 0.464646 0.825
262 SAH 0.463158 0.74359
263 SAI 0.463158 0.734177
264 NAJ PYZ 0.46281 0.85
265 FAY 0.462687 0.8625
266 Y3J 0.4625 0.726027
267 PO4 PO4 A A A A PO4 0.460784 0.902778
268 AAM 0.460674 0.971429
269 RFL 0.459259 0.821429
270 SMM 0.459184 0.686047
271 AMZ 0.458824 0.916667
272 C2R 0.458824 0.90411
273 SAM 0.458333 0.690476
274 A3S 0.456522 0.810811
275 FNK 0.455224 0.804598
276 7C5 0.453704 0.818182
277 AAT 0.453608 0.707317
278 EEM 0.453608 0.690476
279 XNP 0.452991 0.873418
280 AIR 0.451219 0.901408
281 62X 0.45098 0.666667
282 GSP 0.45 0.873418
283 ETB 0.45 0.833333
284 DCA 0.45 0.823529
285 U A G G 0.449153 0.883117
286 NIA 0.448276 0.822785
287 AMP NAD 0.447154 0.881579
288 A3T 0.446809 0.821918
289 K15 0.446602 0.682353
290 A A A 0.446602 0.905405
291 PUA 0.446281 0.884615
292 6K6 0.445545 0.930556
293 GEK 0.445545 0.7375
294 4YB 0.445455 0.761364
295 S7M 0.444444 0.690476
296 DG1 0.443548 0.921053
297 1DG 0.443548 0.921053
298 Z5A 0.443548 0.77907
299 COA 0.442623 0.823529
300 0T1 0.442623 0.823529
301 WSA 0.442478 0.788235
302 8BR 0.43956 0.906667
303 101 0.438202 0.878378
304 IDP 0.4375 0.918919
305 NAP 0.435484 0.945205
306 APU 0.434783 0.894737
307 A U 0.434783 0.87013
308 7RP 0.433333 0.928571
309 A6D 0.432692 0.722892
310 CAO 0.432 0.795455
311 AMX 0.432 0.833333
312 COS 0.432 0.804598
313 TAP 0.432 0.907895
314 J7V 0.432 0.833333
315 30N 0.432 0.752688
316 V1N 0.431193 0.917808
317 649 0.429825 0.744444
318 P5F 0.429577 0.823529
319 NA0 0.428571 0.932432
320 CMX 0.428571 0.823529
321 7RA 0.428571 0.957747
322 SCO 0.428571 0.823529
323 0UM 0.427184 0.698795
324 GAV 0.427184 0.884615
325 ACK 0.426966 0.861111
326 1RB 0.426966 0.885714
327 QQY 0.426966 0.815789
328 GCP 0.425743 0.896104
329 G1R 0.425743 0.907895
330 FAM 0.425197 0.804598
331 FCX 0.425197 0.795455
332 ACO 0.425197 0.795455
333 GNH 0.424242 0.907895
334 F2N 0.423611 0.813953
335 GDC 0.422018 0.884615
336 GDD 0.422018 0.884615
337 GKE 0.422018 0.884615
338 HAX 0.421875 0.804598
339 3AD 0.421687 0.805556
340 GNP 0.421569 0.896104
341 FA9 0.42069 0.864198
342 KB1 0.420561 0.698795
343 TM1 0.420561 0.77381
344 H6Y 0.42 0.945205
345 2MC 0.419847 0.769231
346 3KK 0.418605 0.804598
347 FYN 0.418605 0.823529
348 S8M 0.417476 0.759494
349 2VA 0.416667 0.8
350 NHD 0.416667 0.905405
351 26A 0.416667 0.763158
352 QQX 0.41573 0.805195
353 SOP 0.415385 0.804598
354 OXK 0.415385 0.804598
355 COK 0.415385 0.804598
356 MCD 0.415385 0.804598
357 CA6 0.415385 0.729167
358 YE1 0.413534 0.813953
359 FAI 0.413043 0.916667
360 AS 0.413043 0.833333
361 RMB 0.413043 0.873239
362 1VU 0.412214 0.795455
363 CO6 0.412214 0.804598
364 CMC 0.412214 0.804598
365 NMX 0.412214 0.76087
366 SXZ 0.411215 0.710843
367 ANZ 0.410714 0.8
368 SCA 0.410448 0.804598
369 PLP AAD 0.409836 0.741573
370 SCD 0.409091 0.823529
371 CAJ 0.409091 0.804598
372 NAD BBN 0.408759 0.841463
373 NVA 2AD 0.408163 0.74359
374 D3Y 0.407767 0.789474
375 CC5 0.407407 0.816901
376 U G A 0.407407 0.839506
377 KH3 0.40708 0.674419
378 SLU 0.406504 0.770115
379 G 0.40625 0.906667
380 5GP 0.40625 0.906667
381 BCO 0.406015 0.804598
382 IVC 0.406015 0.813953
383 A1S 0.406015 0.804598
384 MLC 0.406015 0.804598
385 3HC 0.406015 0.813953
386 1HE 0.406015 0.786517
387 GTG 0.405405 0.886076
388 NMN AMP PO4 0.404959 0.87013
389 3D1 0.404762 0.773333
390 3L1 0.404762 0.773333
391 CMP 0.404255 0.901408
392 2BA 0.404255 0.915493
393 SO8 0.40404 0.789474
394 VRT 0.40404 0.769231
395 MCA 0.402985 0.795455
396 CAA 0.402985 0.813953
397 COO 0.402985 0.804598
398 NAD CJ3 0.402878 0.811765
399 G2R 0.401869 0.884615
400 3NZ 0.401869 0.782051
401 ZZB 0.4 0.77381
402 MC4 0.4 0.76087
403 2FA 0.4 0.813333
404 2CP 0.4 0.795455
Ligand no: 2; Ligand: AKG; Similar ligands found: 6
No: Ligand ECFP6 Tc MDL keys Tc
1 AKG 1 1
2 OOG 0.5 0.947368
3 69O 0.458333 0.714286
4 2IT 0.423077 0.615385
5 SHF 0.416667 0.666667
6 3PY 0.409091 0.652174
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4USI; Ligand: AKG; Similar sites found: 45
This union binding pocket(no: 1) in the query (biounit: 4usi.bio1) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5W10 CMP 0.02043 0.40203 None
2 5E5U MLI 0.01095 0.42156 1.2987
3 5DX1 SFG 0.02709 0.40572 1.2987
4 1UYY BGC BGC 0.01207 0.40402 1.52672
5 4D7E FAD 0.01012 0.44775 1.94805
6 3WBF NAP 0.0406 0.42684 2.5974
7 3WBF API 0.04793 0.42684 2.5974
8 4B7P 9UN 0.009364 0.45704 3.24675
9 5MBX FAD 0.01544 0.45289 3.8961
10 5MBX SP5 0.01544 0.45289 3.8961
11 2NZ2 ASP 0.007504 0.41861 3.8961
12 4YJI TYL 0.01221 0.41415 3.8961
13 3W6C NAG NAG 0.04182 0.40454 3.8961
14 4UP3 FAD 0.04242 0.41319 4.54545
15 2XMI FLC 0.01423 0.41094 4.54545
16 4WZ8 3W7 0.02716 0.42597 5.19481
17 1NVM NAD 0.02697 0.41985 5.19481
18 1KC7 PPR 0.003973 0.42673 5.84416
19 5JFL NAD 0.0342 0.40713 5.84416
20 1Q9I TEO 0.01719 0.44175 6.49351
21 5J60 FAD 0.02219 0.42982 6.49351
22 3WQQ IB3 0.04928 0.40806 6.49351
23 3CGD COA 0.03321 0.44126 7.14286
24 3CGD FAD 0.03321 0.44126 7.14286
25 4N9I PCG 0.03827 0.42186 7.79221
26 5FJJ MAN 0.009998 0.4121 7.79221
27 2BLE 5GP 0.0392 0.40298 7.79221
28 5TWJ SAM 0.02713 0.40233 7.79221
29 3NOJ PYR 0.00935 0.41446 8.44156
30 5H6S HDH 0.002967 0.4099 8.44156
31 5N2I NAP 0.03208 0.40391 8.44156
32 3MVH WFE 0.009895 0.44216 9.09091
33 4X9M FAD 0.02088 0.42939 9.09091
34 4BV6 FAD 0.0158 0.44036 10.3896
35 5FJN FAD 0.01811 0.43934 10.3896
36 5FJN BE2 0.02 0.43934 10.3896
37 5JCA NDP 0.04377 0.42676 10.3896
38 5JCA FAD 0.02758 0.42676 10.3896
39 4YSX FAD 0.04497 0.40799 10.3896
40 1V2X SAM 0.03849 0.41748 11.6883
41 5EOB 5QQ 0.03269 0.42361 12.987
42 2XZ9 PYR 0.002701 0.42265 14.9351
43 1D8C GLV 0.01953 0.40552 14.9351
44 4R74 F6P 0.02222 0.40221 15.5844
45 2R4J 13P 0.03859 0.42628 22.0779
Pocket No.: 2; Query (leader) PDB : 4USI; Ligand: ATP; Similar sites found: 105
This union binding pocket(no: 2) in the query (biounit: 4usi.bio1) has 23 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3SAO DBH 0.005875 0.44272 None
2 3KIF GDL 0.005573 0.43754 None
3 4DE2 DN3 0.005901 0.43129 None
4 4DE3 DN8 0.004833 0.4264 None
5 4DDY DN6 0.006607 0.42424 None
6 4DDS 0J7 0.006342 0.42077 None
7 4DE1 0J6 0.006789 0.41936 None
8 1MFI FHC 0.01769 0.40965 None
9 3IWD M2T 0.02082 0.40802 None
10 2GBB CIT 0.02399 0.40482 None
11 2CJU PHX 0.007314 0.43709 1.76991
12 1U18 HSM 0.002569 0.49914 1.94805
13 3KA2 2NC 0.01573 0.41143 2.5974
14 5XDT ZI7 0.009157 0.40025 2.5974
15 1C1L GAL BGC 0.02218 0.41261 2.91971
16 4B9E FAH 0.003948 0.44853 3.24675
17 3AI3 SOE 0.003762 0.44631 3.24675
18 3JQ3 ADP 0.004848 0.43081 3.24675
19 1HQL GLA MBG 0.01424 0.42411 3.24675
20 4EYG VNL 0.006015 0.42187 3.24675
21 1T9D P22 0.02429 0.40454 3.24675
22 4DSU BZI 0.002473 0.459 3.8961
23 4FK7 P34 0.009821 0.43193 3.8961
24 5L2J 6UL 0.009369 0.43047 3.8961
25 5L2J 70E 0.009961 0.43047 3.8961
26 1J6W MET 0.007548 0.42942 3.8961
27 3WWX DIA 0.01299 0.42199 3.8961
28 5AR0 GB8 0.004453 0.40734 3.8961
29 2ZHZ ATP 0.01676 0.40444 3.8961
30 3AXM 6PG 0.02753 0.40137 3.8961
31 1G6H ADP 0.03472 0.40055 3.8961
32 1QKQ MAN 0.0286 0.40583 4.22535
33 3ZO7 K6H 0.01944 0.40528 4.25532
34 1SBR VIB 0.01093 0.42247 4.54545
35 5BVE 4VG 0.01244 0.422 4.54545
36 1K0E TRP 0.008283 0.41129 4.54545
37 2RI1 GLP 0.0201 0.41022 4.54545
38 2GK6 ADP 0.0233 0.4078 4.54545
39 5MW4 5JU 0.01424 0.4066 4.54545
40 2IYF UDP 0.01044 0.40295 4.54545
41 5TVA AMP 0.01672 0.40065 4.54545
42 3EFS BTN 0.008061 0.40113 5.19481
43 2WZ5 MET 0.001855 0.43589 5.22876
44 3BY8 MLT 0.02596 0.40303 5.6338
45 2QPU QPS 0.003837 0.44065 5.84416
46 2QPU QPU 0.004451 0.43742 5.84416
47 3CBC DBS 0.00788 0.43733 5.84416
48 1GPM AMP 0.007326 0.43597 5.84416
49 2IVD ACJ 0.006574 0.42003 5.84416
50 4ARE FLC 0.01114 0.41135 5.84416
51 2GU8 796 0.01839 0.41051 5.84416
52 1RYD GLC 0.02609 0.40977 5.84416
53 1FQK ALF 0.02161 0.40731 6.12245
54 1G51 AMP 0.002371 0.46027 6.49351
55 4WOE ADP 0.01131 0.42439 6.49351
56 4KBA 1QM 0.01079 0.41814 6.49351
57 5LX9 OLB 0.006628 0.4158 6.49351
58 2FXU ATP 0.02857 0.40552 6.49351
59 1IS3 LAT 0.01106 0.43076 6.66667
60 3V3L V3L 0.01896 0.40181 7.05882
61 1OFL NGK GCD 0.003743 0.44938 7.14286
62 5XLY C2E 0.001868 0.43276 7.14286
63 5EW9 5VC 0.02815 0.42191 7.14286
64 1WD4 AHR 0.01215 0.41555 7.14286
65 1PVS 7HP 0.01538 0.41378 7.14286
66 1TL2 NDG 0.0213 0.4075 7.14286
67 1U4J MAN 0.02418 0.40927 7.62712
68 1G8K MGD 0.04025 0.40302 7.79221
69 4RHS SIA SIA GAL 0.01498 0.41451 8.19672
70 1W0O SIA 0.007718 0.43318 8.44156
71 2D24 XYS XYS 0.01372 0.40799 8.44156
72 3B6R ADP 0.008528 0.40697 8.44156
73 3DLG GWE 0.03227 0.40362 8.44156
74 2C42 TPP 0.01104 0.40071 8.44156
75 2C42 PYR 0.01104 0.40071 8.44156
76 1VBO MAN MAN MAN 0.01492 0.41661 8.72483
77 1VBO MAN 0.02392 0.40205 8.72483
78 3ZJX BOG 0.008118 0.43046 9.09091
79 4C2C ALA ALA ALA 0.03322 0.40481 9.09091
80 2XG5 EC5 0.01512 0.4039 9.09091
81 2XG5 EC2 0.01512 0.4039 9.09091
82 4AF5 CIT 0.03407 0.40045 9.74026
83 4Q3F TLA 0.03767 0.4007 10.2564
84 1FHW I5P 0.02447 0.40438 10.8527
85 1FHX 4IP 0.02845 0.40097 10.8527
86 1GPJ CIT 0.02767 0.40465 11.039
87 1HXD BTN 0.01017 0.40002 11.039
88 1K7U NAG NAG 0.01602 0.41625 11.6883
89 1YBH P22 0.01262 0.41049 11.6883
90 1VRP ADP 0.00977 0.40794 11.6883
91 4CJN QNZ 0.02529 0.40753 12.3377
92 2VAR AMP 0.01567 0.40588 12.3377
93 2PNC CLU 0.004536 0.44347 12.987
94 1V6A TRE 0.02901 0.40249 13.6364
95 3QSB 743 0.01853 0.4023 13.6364
96 2W5P CL8 0.02361 0.40396 14.7651
97 5FUI APY 0.0003056 0.50155 15.1515
98 2IU8 PLM 0.001016 0.43235 15.5844
99 3DZ6 PUT 0.007694 0.42342 15.5844
100 4MOB ADP 0.03205 0.40083 15.5844
101 3TW1 AHN 0.02491 0.40607 20.7792
102 3NKS ACJ 0.003779 0.42305 21.4286
103 3H0L ADP 0.02402 0.40064 22.0779
104 1W8S FBP 0.01004 0.41126 24.6753
105 4HZO COA 0.02431 0.40452 28.5714
Pocket No.: 3; Query (leader) PDB : 4USI; Ligand: ATP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 4usi.bio1) has 23 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 4USI; Ligand: AKG; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 4usi.bio1) has 11 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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