Receptor
PDB id Resolution Class Description Source Keywords
3MHY 1.4 Å NON-ENZYME: OTHER A NEW PII PROTEIN STRUCTURE AZOSPIRILLUM BRASILENSE PII PROTEIN ALPHA-BETA PROTEIN HOMOTRIMER SIGNALING PROTE
Ref.: A NEW P(II) PROTEIN STRUCTURE IDENTIFIES THE 2-OXOG BINDING SITE. J.MOL.BIOL. V. 400 531 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
AKG A:114;
B:114;
C:114;
Valid;
Valid;
Valid;
none;
none;
none;
submit data
146.098 C5 H6 O5 C(CC(...
ATP A:113;
B:113;
C:113;
Valid;
Valid;
Valid;
none;
none;
none;
submit data
507.181 C10 H16 N5 O13 P3 c1nc(...
MES B:116;
Invalid;
none;
submit data
195.237 C6 H13 N O4 S C1COC...
MG A:115;
A:116;
B:115;
C:115;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
PG6 A:118;
B:117;
B:118;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
266.331 C12 H26 O6 COCCO...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4CO3 1.05 Å NON-ENZYME: OTHER STRUCTURE OF PII SIGNALING PROTEIN GLNZ FROM AZOSPIRILLUM BRASILENSE IN COMPLEX WITH ADENOSINE TRIPHOSPHATE AZOSPIRILLUM BRASILENSE SIGNALING PROTEIN GLNK-LIKE
Ref.: STRUCTURE AND THERMODYNAMICS OF EFFECTOR MOLECULE B TO THE NITROGEN SIGNAL TRANSDUCTION PII PROTEIN GLN AZOSPIRILLUM BRASILENSE. J.MOL.BIOL. V. 426 2783 2014
Members (7)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 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....
70% Homology Family (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1068 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 3TA2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
9 2GNK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
10 3LF0 Kd = 1.93 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
11 2J9C - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
12 5L9N - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
13 2XBP Kd = 9.6 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
14 2XZW - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
15 4AFF - FLC C6 H5 O7 C(C(=O)[O-....
16 2XUL - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
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: 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
Ligand no: 2; 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
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4CO3; Ligand: ATP; Similar sites found: 197
This union binding pocket(no: 1) in the query (biounit: 4co3.bio1) has 84 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1XX4 BAM 0.0001737 0.51368 None
2 1BTN I3P 0.009447 0.48301 None
3 3I8T LBT 0.0009286 0.47682 None
4 1UO4 PIH 0.01126 0.46467 None
5 1UW1 ADP 0.00441 0.45151 None
6 3QDY A2G GAL 0.0105 0.45139 None
7 4B16 NAG 0.02206 0.44808 None
8 1UO5 PIH 0.03026 0.44802 None
9 3MAG 3MA 0.02244 0.44766 None
10 1NU4 MLA 0.007879 0.44521 None
11 3JUC PCA 0.007968 0.44477 None
12 1OGD RIP 0.004808 0.44427 None
13 3KPE TM3 0.008303 0.4441 None
14 2Y7P SAL 0.005208 0.44268 None
15 3QDY CBS 0.01355 0.43939 None
16 2QLX RM4 0.01575 0.43609 None
17 1LYX PGA 0.003817 0.4298 None
18 3UEC ALA ARG TPO LYS 0.02161 0.42912 None
19 3O2K QRP 0.006845 0.42781 None
20 3RK0 AMP 0.00586 0.42634 None
21 3EJ0 11X 0.0143 0.42497 None
22 3QDT A2G GAL 0.03952 0.4211 None
23 1UF5 CDT 0.01037 0.42002 None
24 1ECM TSA 0.01346 0.41933 None
25 3MAG SAH 0.003548 0.41577 None
26 2YCD GTB 0.01187 0.41348 None
27 1MZV AMP 0.01499 0.4131 None
28 2RI1 GLP 0.02657 0.41073 None
29 1QD0 RR6 0.01637 0.4076 None
30 3IWD M2T 0.03062 0.40691 None
31 4FUA PGH 0.002015 0.40526 None
32 4BX7 B4F 0.002217 0.40393 None
33 1CTU ZEB 0.01119 0.40371 None
34 3GFS FMN 0.02309 0.40252 None
35 1UI0 URA 0.04616 0.40252 None
36 1Y2W NAG 0.04132 0.40993 1.78571
37 2F2U M77 0.002665 0.44544 2.67857
38 1FAO 4IP 0.01051 0.4324 2.67857
39 4Q3S X7A 0.0005467 0.42682 2.67857
40 3VCA PRO 0.01391 0.42554 2.67857
41 4E28 9MZ 0.0289 0.4176 2.67857
42 2DWU DGL 0.01638 0.41553 2.67857
43 2RCN GDP 0.02146 0.40636 2.67857
44 4E28 0MZ 0.04511 0.40365 2.67857
45 3E81 SLB 0.04713 0.40274 2.67857
46 1I2L DCS 0.008847 0.40113 2.67857
47 1H8G CHT 0.01904 0.46002 3.15789
48 4B9E FAH 0.0009401 0.49769 3.57143
49 1QDS PGA 0.002316 0.44806 3.57143
50 3K3G MMU 0.02154 0.41667 3.57143
51 2BOI MFU 0.03178 0.40665 3.57143
52 1JN2 SFP 0.002449 0.49736 4.46429
53 4JCA CIT 0.005845 0.48078 4.46429
54 2B7N NTM 0.003278 0.45757 4.46429
55 2BO4 FLC 0.008412 0.44984 4.46429
56 1K6M AGS 0.001529 0.42198 4.46429
57 1ONX ASP 0.000671 0.42061 4.46429
58 2CJZ PTR 0.01508 0.4198 4.46429
59 1TH8 ADP 0.01236 0.41673 4.46429
60 3MD0 GDP 0.02034 0.41134 4.46429
61 4K30 NLG 0.03535 0.40451 4.46429
62 2R5T ANP 0.007673 0.40031 4.46429
63 1A5Z OXM 0.00009229 0.5585 5.35714
64 1A8S PPI 0.0002932 0.48363 5.35714
65 2EB5 OXL 0.009509 0.44123 5.35714
66 1QO0 BMD 0.01607 0.43011 5.35714
67 1JSH SIA GAL 0.001762 0.41981 5.35714
68 1B5E DCM 0.01373 0.41895 5.35714
69 1Y75 NAG 0.02592 0.40664 5.35714
70 4HZO COA 0.03532 0.40453 5.35714
71 3EW2 BTN 0.02945 0.40414 5.35714
72 1WKL ADP 0.00928 0.40354 5.35714
73 4QDC ASD 0.002142 0.40298 5.35714
74 1SS4 GSH 0.001786 0.52803 6.25
75 4M51 BEZ 0.01482 0.44355 6.25
76 1V8K ANP 0.00004519 0.44316 6.25
77 4JEJ 1GP 0.004928 0.42949 6.25
78 3T1A 5MA 0.001956 0.42908 6.25
79 3VGL BGC 0.0002836 0.42589 6.25
80 1C1L GAL BGC 0.02593 0.4251 6.25
81 3CXQ GLP 0.02949 0.41249 6.25
82 4AF5 CIT 0.0378 0.41185 6.25
83 1G6H ADP 0.03898 0.40159 6.25
84 1HQL GLA MBG 0.04504 0.40154 6.25
85 1HYE NAP 0.005119 0.40053 6.25
86 3F81 STT 0.001997 0.49755 7.14286
87 2HVK TBA 0.0007824 0.49395 7.14286
88 4RJK PYR 0.002865 0.48083 7.14286
89 4COQ SAN 0.0114 0.4374 7.14286
90 1GPJ CIT 0.01285 0.43485 7.14286
91 1ZJ6 G3D 0.01029 0.41608 7.14286
92 2AWN ADP 0.02077 0.41469 7.14286
93 2QV7 ADP 0.008384 0.41213 7.14286
94 4DYO SD4 0.01963 0.41203 7.14286
95 1F7K UMP 0.002706 0.4085 7.14286
96 2OAT PFM 0.01322 0.4009 7.14286
97 2Q8H TF4 0.005555 0.47348 8.03571
98 2Q8M AMP 0.002979 0.43864 8.03571
99 2NCD ADP 0.009103 0.43667 8.03571
100 2JFV FLC 0.01251 0.43541 8.03571
101 4NAO AKG 0.01925 0.43167 8.03571
102 1VL1 CIT 0.01451 0.42726 8.03571
103 2Z9V PXM 0.01215 0.42586 8.03571
104 1FNZ A2G 0.002867 0.41238 8.03571
105 1RTF BEN 0.02867 0.41112 8.03571
106 1ML4 PAL 0.005035 0.40852 8.03571
107 1Q3Q ANP 0.0001637 0.40776 8.03571
108 1Q6O LG6 0.01257 0.40513 8.03571
109 2FN1 PYR 0.04964 0.40414 8.03571
110 2OWZ CIT 0.004994 0.4039 8.03571
111 3I8P 840 0.01526 0.40176 8.03571
112 3L6R MLI 0.0004677 0.51292 8.92857
113 4M5P MLA 0.00415 0.48919 8.92857
114 3E5P PPI 0.01269 0.47758 8.92857
115 3LTW HLZ 0.001994 0.47422 8.92857
116 3BY8 MLT 0.003891 0.46669 8.92857
117 3GTD MLI 0.006423 0.44381 8.92857
118 1UOU CMU 0.002038 0.44091 8.92857
119 4AF0 MOA 0.0005667 0.42977 8.92857
120 4UAL 3FV 0.003896 0.42148 8.92857
121 4IEN GDP 0.0004251 0.42048 8.92857
122 4IEE AGS 0.02388 0.40935 8.92857
123 2HNK SAH 0.006166 0.40692 8.92857
124 2O2C G6Q 0.0151 0.40194 8.92857
125 3SHR CMP 0.02894 0.40071 8.92857
126 3B20 NAD 0.003532 0.4002 8.92857
127 2IMP NAI 0.001052 0.40001 8.92857
128 3CH5 GDP 0.003138 0.4377 9.61539
129 3NGU ADP 0.0004797 0.46647 9.82143
130 2YIV YIV 0.005499 0.46606 9.82143
131 3CEV ARG 0.001371 0.4633 9.82143
132 1Y1A GSH 0.02759 0.45738 9.82143
133 1G51 AMP 0.006972 0.44505 9.82143
134 1S2D ADE 0.003467 0.43151 9.82143
135 1FP2 SAH 0.00432 0.42761 9.82143
136 1J2Z SOG 0.003795 0.42384 9.82143
137 2GWD GLU 0.01882 0.41285 9.82143
138 4WB7 ATP 0.0114 0.41228 9.82143
139 3CQ5 PMP 0.02759 0.40542 9.82143
140 1SC3 MLI 0.003815 0.47434 10.7143
141 1A59 COA 0.0007307 0.44521 10.7143
142 3L24 GOA 0.03531 0.42969 10.7143
143 1H0C AOA 0.02862 0.42292 10.7143
144 1B0U ATP 0.01588 0.40107 10.7143
145 3VOZ 04A 0.001929 0.43329 11.6071
146 4E13 NAD 0.00272 0.41653 11.6071
147 1Z41 FMN 0.006915 0.41545 11.6071
148 2CE7 ADP 0.01034 0.41215 11.6071
149 3PLN U5P 0.02813 0.4091 11.6071
150 1V5F FAD 0.003772 0.4067 11.6071
151 1V5F TPP 0.003772 0.4067 11.6071
152 2Q1A 2KT 0.0002251 0.4512 12.5
153 2NVK NAP 0.00358 0.45011 12.5
154 1PX8 XYP 0.01661 0.42433 12.5
155 3PC3 P1T 0.002681 0.41676 12.5
156 2Z5Y HRM 0.0007864 0.41225 12.5
157 3CI3 3PO 0.001288 0.40565 12.5
158 3CI3 5AD 0.001288 0.40565 12.5
159 2ZWS PLM 0.007393 0.48439 13.3929
160 1GJW GLC 0.006652 0.45497 13.3929
161 1O9U ADZ 0.01373 0.45213 13.3929
162 4C2G ALA ALA ALA ALA 0.00973 0.4256 13.3929
163 2C9O ADP 0.0003074 0.41558 13.3929
164 3U1T MLI 0.04978 0.41061 13.3929
165 3I0O ADP 0.02512 0.40338 13.3929
166 3KJQ B94 0.006441 0.42462 13.6842
167 1NXJ GLV 0.0006355 0.47806 14.2857
168 1NXJ TLA 0.0002343 0.47119 14.2857
169 3SQG COM 0.01957 0.45104 14.2857
170 3ZPG 5GP 0.02536 0.43758 14.2857
171 1FWV SGA MAG FUC 0.01491 0.42308 14.2857
172 2ZJ5 ADP 0.03364 0.40976 14.2857
173 2WZ5 MET 0.02131 0.40749 14.2857
174 1H16 DTL 0.01156 0.4562 16.0714
175 1H16 PYR 0.02657 0.43022 16.0714
176 3JQ3 ADP 0.001029 0.46321 16.9643
177 1I0Z OXM 0.01403 0.45162 16.9643
178 1V6A TRE 0.007887 0.43961 16.9643
179 1T10 F6P 0.02096 0.41954 16.9643
180 3NOJ PYR 0.003389 0.45399 17.8571
181 1TV5 A26 0.00007208 0.46856 18.75
182 1TV5 ORO 0.007263 0.41278 18.75
183 1TV5 N8E 0.01065 0.40128 18.75
184 2JBH 5GP 0.001357 0.46349 19.6429
185 1Y42 TYR 0.03096 0.40718 21.4286
186 4MOB COA 0.00006763 0.41629 22.3214
187 1U1J C2F 0.04183 0.40367 22.3214
188 1YBH P22 0.008974 0.42689 24.1071
189 2Y6P CTP 0.02402 0.40422 24.1071
190 2VAR KDF 0.01281 0.41208 25
191 2VAR KDG 0.01651 0.40744 25
192 2VAR ANP 0.005422 0.40574 25
193 4KCT PYR 0.0133 0.41957 25.8929
194 4KCT FDP 0.01542 0.40869 25.8929
195 2IZ1 ATR 0.01614 0.43001 28.5714
196 1G8S MET 0.01003 0.44009 29.4643
197 1W7J ADP BEF 0.0007538 0.44906 30.3571
Pocket No.: 2; Query (leader) PDB : 4CO3; Ligand: ATP; Similar sites found: 85
This union binding pocket(no: 2) in the query (biounit: 4co3.bio2) has 84 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2ZO9 MLI 0.0003984 0.47634 None
2 4F8L GAL 0.01632 0.46267 None
3 43CA NPO 0.04266 0.43998 None
4 2BS5 BGC GAL FUC 0.00022 0.43808 None
5 1ULE GLA GAL NAG 0.01808 0.43769 None
6 1T0I FMN 0.002877 0.42127 None
7 2HFK E4H 0.01435 0.42121 None
8 4F4S EFO 0.01637 0.41859 None
9 2OFE NAG 0.02713 0.41766 None
10 2BES RES 0.009046 0.41705 None
11 4C81 CDP 0.00387 0.41122 None
12 3BIB PSF 0.02622 0.40968 None
13 1LTH NAD 0.0002294 0.40928 None
14 3W8S GSH 0.04247 0.40366 None
15 3F8C HT1 0.04262 0.40359 None
16 1CKM GTP 0.01699 0.4135 1.78571
17 3A2Y TS5 0.005843 0.41324 2.67857
18 4OB6 S2T 0.00998 0.40774 2.67857
19 4OYA 1VE 0.001483 0.40757 2.67857
20 1WRA PC 0.03489 0.41727 3.57143
21 1QZZ SAM 0.011 0.40968 3.57143
22 1N9L FMN 0.00618 0.4088 3.66972
23 3S9K CIT 0.003817 0.49188 4.46429
24 2GN2 C5P 0.0004513 0.45603 4.46429
25 1PEA ACM 0.01539 0.44136 4.46429
26 1MVQ MMA 0.0003889 0.41388 4.46429
27 3K37 BCZ 0.0006401 0.40768 4.46429
28 4QCK ASD 0.002099 0.40611 4.46429
29 1EYQ NAR 0.005137 0.43647 5.35714
30 1O7N IND 0.001478 0.42095 5.35714
31 1WKL ATP 0.004386 0.4144 5.35714
32 3MMR ABH 0.001306 0.41284 5.35714
33 1CBF SAH 0.009284 0.40898 5.35714
34 4LN7 1ZQ 0.009687 0.40477 5.35714
35 2BH9 NAP 0.01208 0.40445 5.35714
36 2Q37 3AL 0.006709 0.44151 6.25
37 1SS4 CIT 0.01171 0.44101 6.25
38 1EYE PMM 0.01254 0.41111 6.25
39 3VGL ANP 0.0002014 0.405 6.25
40 4DSU BZI 0.04363 0.40424 6.25
41 1B4P GPS 0.009946 0.40102 6.25
42 9LDT OXM 0.04023 0.43189 7.14286
43 4P4T GDP 0.007147 0.40643 7.14286
44 4IMG NGF 0.006191 0.40544 7.14286
45 1T0S BML 0.01747 0.43848 8.03571
46 4KOA NDP 0.003032 0.42421 8.03571
47 1WDA BAG 0.01257 0.41929 8.03571
48 4GLW NMN 0.02393 0.40127 8.03571
49 1Q3P GLU ALA GLN THR ARG LEU 0.03332 0.40047 8.25688
50 4M5P 23W 0.004188 0.47078 8.92857
51 4IEN COA 0.00008867 0.42942 8.92857
52 3P7I P7I 0.0188 0.41584 8.92857
53 1BDB NAD 0.0005237 0.40739 8.92857
54 1NHZ 486 0.005204 0.40184 8.92857
55 4IU0 ABH 0.0003893 0.44118 9.82143
56 1KTC NGA 0.02252 0.41225 9.82143
57 4IHQ ADP 0.02469 0.40628 9.82143
58 1A59 CIT 0.01228 0.4402 10.7143
59 3RO7 TDR 0.0009823 0.41114 10.7143
60 1EB9 HBA 0.01329 0.41007 10.7143
61 1U5R ATP 0.01114 0.40584 10.7143
62 1I1E DM2 0.03266 0.40497 10.7143
63 2QS8 MET 0.000006816 0.40342 10.7143
64 2NZ2 ASP 0.004049 0.44622 11.6071
65 2Q09 DI6 0.03213 0.40118 11.6071
66 2V5E SCR 0.01445 0.45719 11.8812
67 3TKA CTN 0.02273 0.44503 12.5
68 2QCX PF1 0.008942 0.43566 12.5
69 3TKA SAM 0.002396 0.41701 12.5
70 1SQ5 ADP 0.01154 0.41263 12.5
71 3QV9 QV7 0.01397 0.42654 13.3929
72 4G28 0W8 0.02584 0.4054 13.3929
73 4W6Z ETF 0.002466 0.49109 14.2857
74 1MXI SAH 0.002842 0.42147 14.2857
75 1XX6 ADP 0.01025 0.41886 15.1786
76 1IZC PYR 0.002764 0.41145 16.0714
77 3ZZS TRP 0.0004717 0.40043 16.9231
78 2BZ1 TAU 0.01735 0.46109 16.9643
79 3NBK PNS 0.0008194 0.40578 18.75
80 4MOB ADP 0.0006732 0.45163 22.3214
81 1YBH FAD 0.001526 0.40205 24.1071
82 4G4S LDZ 0.009548 0.40501 25
83 4KBF AMP 0.0314 0.40189 27.6786
84 3I51 45C 0.005263 0.42686 28.5714
85 1WNG SAH 0.006734 0.4041 32.1429
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