Receptor
PDB id Resolution Class Description Source Keywords
3W2W 2.5 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE CMR2DHD-CMR3 SUBCOMPLEX BOUND TO AT PYROCOCCUS FURIOSUS FERREDOXIN-LIKE FOLD IMMUNE SYSTEM
Ref.: CRYSTAL STRUCTURE OF THE CMR2-CMR3 SUBCOMPLEX IN TH CRISPR-CAS RNA SILENCING EFFECTOR COMPLEX. J.MOL.BIOL. V. 425 3811 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:904;
B:401;
Part of Protein;
Invalid;
none;
none;
submit data
24.305 Mg [Mg+2...
ATP A:902;
A:903;
Valid;
Valid;
none;
none;
submit data
507.181 C10 H16 N5 O13 P3 c1nc(...
ZN A:901;
Part of Protein;
none;
submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3W2W 2.5 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE CMR2DHD-CMR3 SUBCOMPLEX BOUND TO AT PYROCOCCUS FURIOSUS FERREDOXIN-LIKE FOLD IMMUNE SYSTEM
Ref.: CRYSTAL STRUCTURE OF THE CMR2-CMR3 SUBCOMPLEX IN TH CRISPR-CAS RNA SILENCING EFFECTOR COMPLEX. J.MOL.BIOL. V. 425 3811 2013
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 3W2W - 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 1068 families.
1 3W2W - 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 922 families.
1 3W2W - 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
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3W2W; Ligand: ATP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 3w2w.bio2) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3W2W; Ligand: ATP; Similar sites found: 296
This union binding pocket(no: 2) in the query (biounit: 3w2w.bio2) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3IL6 B83 0.00507 0.40109 1.86916
2 4M5P MLA 0.006719 0.43959 1.9656
3 4M5P 23W 0.0182 0.40345 1.9656
4 1I9G SAM 0.003536 0.43786 2.14286
5 2NVK NAP 0.003947 0.40916 2.17391
6 3ZGE ASP 0.003075 0.43962 2.48447
7 3IB9 BTN 0.01083 0.41078 2.48447
8 1T8U A3P 0.0008649 0.43019 2.57353
9 1T8U UAP SGN IDS SGN 0.01583 0.40407 2.57353
10 1SOW NAD 0.004241 0.42079 2.7439
11 1PEA ACM 0.0006211 0.47204 2.79503
12 4CMF PXG 0.00106 0.46365 2.79503
13 4USQ FAD 0.005504 0.41863 2.79503
14 4G1V FAD 0.004658 0.41384 2.79503
15 3WO0 ALA 0.01245 0.40635 2.79503
16 3WO0 ADP 0.01245 0.40635 2.79503
17 3C1O NAP 0.004072 0.41162 2.80374
18 1H16 PYR 0.0178 0.40391 2.8065
19 3LTW HLZ 0.0008057 0.45057 2.85714
20 3ZPG 5GP 0.007206 0.42975 2.87958
21 3U1T MLI 0.01278 0.40442 2.91262
22 1T10 F6P 0.001664 0.43036 2.97521
23 1GAD NAD 0.003029 0.41974 3.0303
24 1PL6 572 0.00568 0.4169 3.08989
25 1PL6 NAD 0.002444 0.41682 3.08989
26 4I71 AGV 0.003006 0.40774 3.10559
27 2PT9 2MH 0.004417 0.42251 3.11526
28 2PT9 S4M 0.003639 0.4151 3.11526
29 1JA9 PYQ 0.003511 0.42011 3.28467
30 1UAY ADN 0.0006354 0.41532 3.30579
31 4LWA Q13 0.01726 0.40346 3.30579
32 2YIV YIV 0.004711 0.43096 3.35366
33 2YIV NBN 0.003489 0.42976 3.35366
34 2CSN CKI 0.002357 0.42247 3.367
35 4G10 GSH 0.00116 0.41883 3.39623
36 2DTX BMA 0.005758 0.42325 3.40909
37 3GTD MLI 0.0004776 0.4529 3.41615
38 3L6R MLI 0.00168 0.44399 3.41615
39 1I0Z OXM 0.02436 0.40382 3.41615
40 1P9P SAH 0.001828 0.42167 3.44828
41 1GSA ADP 0.01633 0.41139 3.48101
42 4PLG NAI 0.003354 0.43081 3.59281
43 4PLG OXM 0.003354 0.43081 3.59281
44 2DKH FAD 0.003225 0.42684 3.59937
45 3OZG SSI 0.002465 0.4067 3.6
46 1O9U ADZ 0.002899 0.44904 3.71429
47 1QF5 RPL 0.001058 0.46186 3.72671
48 1QF5 GDP 0.001058 0.46186 3.72671
49 4RJK PYR 0.01398 0.40884 3.72671
50 2ZJ3 G6P 0.003468 0.40734 3.73333
51 2QIA U20 0.007139 0.43027 3.81679
52 1UXG FUM 0.0009733 0.45403 3.8835
53 1UXG NAD 0.0009733 0.45403 3.8835
54 4LHM AZZ 0.006768 0.40499 4.09091
55 2WGC SIA GAL BGC 0.009184 0.44178 4.09357
56 4HA6 PXM 0.008129 0.40167 4.13386
57 4B16 NAG 0.006372 0.44077 4.13534
58 1WDA BAG 0.002466 0.41188 4.1791
59 4JCA CIT 0.0004588 0.49905 4.19162
60 4AF5 CIT 0.0001364 0.48383 4.21053
61 4GYW UDP 0.007034 0.41194 4.28769
62 2WQP WQP 0.007604 0.40402 4.29799
63 4IVG ANP 0.004967 0.43505 4.32767
64 2ZWS PLM 0.00007067 0.55504 4.34783
65 4W6Z ETF 0.003352 0.44596 4.34783
66 2YVF FAD 0.004468 0.44383 4.34783
67 2YVF NAD 0.01801 0.41798 4.34783
68 1Z45 GAL 0.006148 0.40142 4.34783
69 1E7S NAP 0.007508 0.4108 4.36137
70 4C2G ALA ALA ALA ALA 0.004903 0.40029 4.4843
71 3OIG NAD 0.005183 0.44032 4.51128
72 2HGZ PBF 0.001758 0.4258 4.57516
73 2QDT I38 0.003268 0.40216 4.57903
74 3P3N AKG 0.0009906 0.4467 4.58453
75 4B7E OGA 0.0009717 0.44007 4.58453
76 1H2K OGA 0.01152 0.40068 4.58453
77 3VPD ANP 0.004795 0.40383 4.62633
78 2IZ1 ATR 0.0007437 0.45207 4.64135
79 1DXY COI 0.004308 0.44065 4.65839
80 1KBJ FMN 0.00118 0.43421 4.65839
81 2NLI FMN 0.02054 0.40866 4.65839
82 2NLI LAC 0.02054 0.40866 4.65839
83 4HZX G39 0.0174 0.40331 4.65839
84 1C0I BE2 0.005215 0.43074 4.6832
85 1C0I FAD 0.005215 0.43074 4.6832
86 1QH9 LAC 0.0004129 0.46309 4.74138
87 1ZED PNP 0.005093 0.42239 4.96894
88 2J8Z NAP 0.004321 0.41653 4.96894
89 3UR0 SVR 0.01285 0.41334 4.96894
90 1R6W 164 0.0007913 0.4036 4.96894
91 3DGB MUC 0.002654 0.40078 4.97382
92 1NW5 SAM 0.004471 0.40316 5.01567
93 1O68 KIV 0.00171 0.42376 5.09091
94 1B74 DGN 0.01146 0.41289 5.11811
95 5D63 FUC GLA GLA 0.002545 0.42902 5.11945
96 1NU4 MLA 0.002196 0.47512 5.15464
97 3EW2 BTN 0.004948 0.40013 5.18518
98 1R37 NAD 0.0009432 0.44972 5.18732
99 1G8S MET 0.0006476 0.45466 5.21739
100 1SS4 CIT 0.001949 0.43653 5.22876
101 1SS4 GSH 0.02217 0.42336 5.22876
102 3E6J DR2 0.0199 0.41168 5.24017
103 4KCF AKM 0.001978 0.42212 5.2795
104 2Q09 DI6 0.00328 0.40708 5.2795
105 4KCF FMN 0.002222 0.40359 5.2795
106 4B9E FAH 0.006228 0.41846 5.31561
107 1TDF NAP 0.003516 0.45431 5.37975
108 1TDF FAD 0.01599 0.41097 5.37975
109 1XVV CCQ 0.0083 0.41667 5.39216
110 1FIQ MTE 0.003319 0.42246 5.47945
111 1FIQ SAL 0.003856 0.42246 5.47945
112 1FIQ FAD 0.01546 0.40036 5.47945
113 2CKM AA7 0.01691 0.40567 5.52486
114 1RZM E4P 0.002461 0.43656 5.6213
115 1RZM PEP 0.005936 0.40203 5.6213
116 1S8F GDP 0.001648 0.40113 5.64972
117 1FBL HTA 0.001926 0.41079 5.67568
118 3SHR CMP 0.00141 0.41589 5.68562
119 2IMP NAI 0.02151 0.4224 5.90062
120 1WVG APR 0.002855 0.41922 5.90062
121 1WVG CXY 0.0039 0.40903 5.90062
122 2OWZ CIT 0.001867 0.43482 6.0241
123 2NZ2 ASP 0.001357 0.42778 6.05327
124 3Q9T FAY 0.004846 0.42531 6.06586
125 3SQG COM 0.001167 0.47839 6.09319
126 2GSD NAD 0.002408 0.43441 6.21118
127 4OYA 1VE 0.03054 0.42261 6.21118
128 4HZO COA 0.003396 0.41178 6.28931
129 3A1I UNU 0.001063 0.42049 6.33397
130 1Y2W NAG 0.001318 0.44135 6.33803
131 2Q8H TF4 0.001877 0.45823 6.38821
132 2VAR KDG 0.002003 0.40523 6.38978
133 2H6B 3C4 0.003273 0.4169 6.4
134 2QLX RM4 0.000509 0.46724 6.48148
135 1WRA PC 0.01374 0.40301 6.49351
136 1XX4 BAM 0.00387 0.44292 6.51341
137 3MAG 3MA 0.01177 0.42713 6.51466
138 2P69 PLP 0.00219 0.4254 6.53595
139 2HFK E4H 0.002305 0.41855 6.58307
140 1NVU GTP 0.01519 0.41722 6.62651
141 3EJ0 11X 0.004822 0.40835 6.63265
142 1CKM GTP 0.001396 0.42148 6.66667
143 1CKN GTP 0.001028 0.4039 6.66667
144 3MCT 3MC 0.005315 0.40396 6.73401
145 2DTJ THR 0.0005885 0.43014 6.74157
146 1WUR 8DG 0.004004 0.40859 6.81818
147 1RYI GOA 0.001417 0.48833 6.8323
148 3L24 GOA 0.009271 0.4244 6.8323
149 2V5E SCR 0.006876 0.43908 6.93069
150 2HMT NAI 0.003619 0.43921 6.94444
151 1NML CIT 0.002892 0.41459 7.05521
152 3IHB TRS 0.00003086 0.58823 7.14286
153 3IHB GLU 0.004134 0.42646 7.14286
154 2WCV FUC 0.001808 0.41182 7.14286
155 1LTH NAD 0.007482 0.42902 7.21003
156 4O1M NAD 0.003688 0.42063 7.30159
157 1TIW TFB 0.001064 0.45244 7.45342
158 1TIW FAD 0.001064 0.45244 7.45342
159 3S9K CIT 0.0002617 0.5343 7.62712
160 1MZV AMP 0.002327 0.4077 7.65957
161 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.01556 0.40628 7.69231
162 2C7G FAD 0.008841 0.42812 7.76398
163 2C7G ODP 0.008641 0.42782 7.76398
164 4NTD FAD 0.006196 0.42091 7.76398
165 3DG6 MUC 0.001822 0.40023 7.76398
166 3GE7 AFQ 0.004274 0.42189 7.77202
167 3TKA CTN 0.0005607 0.51173 7.78098
168 2HGS ADP 0.0005006 0.44325 7.80591
169 3U4C NDP 0.003654 0.41942 7.82918
170 4M51 BEZ 0.0007505 0.4682 7.96253
171 3V1U NAD 0.001988 0.42536 8.00866
172 1KOL NAD 0.01092 0.40868 8.07453
173 2F2U M77 0.003188 0.40257 8.07453
174 1QO0 BMD 0.000179 0.47874 8.16327
175 3F81 STT 0.003577 0.44459 8.19672
176 3O03 NAP 0.006351 0.4071 8.24742
177 1JUV NDP 0.002234 0.42494 8.29016
178 2WM1 13P 0.0007736 0.40154 8.33333
179 2Z9V PXM 0.001143 0.43078 8.38509
180 1RY2 AMP 0.004114 0.41302 8.38509
181 3P7I P7I 0.0003429 0.45176 8.41121
182 1BGQ RDC 0.006208 0.40749 8.44444
183 1QD0 RR6 0.0005566 0.42547 8.59375
184 2XI7 XI7 0.001423 0.48522 8.69565
185 1JGS SAL 0.003542 0.464 8.69565
186 1P72 THM 0.005376 0.40376 8.69565
187 1Y1A GSH 0.004928 0.46018 8.74317
188 1A5V Y3 0.004976 0.41056 8.86076
189 4COQ SAN 0.003434 0.4234 8.90688
190 1GJW GLC 0.003549 0.42943 9.00621
191 2GWD GLU 0.002305 0.41303 9.00621
192 1EDO NAP 0.04839 0.40232 9.01639
193 1WHT BZS 0.000697 0.45328 9.15033
194 2OFD NGA 0.0003527 0.46603 9.15493
195 2OFE NAG 0.004539 0.41817 9.15493
196 1DL7 NCH 0.0162 0.4285 9.17431
197 1QR0 COA 0.002349 0.40755 9.21053
198 2J7T 274 0.001797 0.43166 9.27152
199 1T0S BML 0.008519 0.41893 9.30233
200 3B9Z CO2 0.001683 0.43677 9.31677
201 2XK9 XK9 0.005412 0.41893 9.31677
202 3MBG FAD 0.005959 0.40672 9.35252
203 1IYE PGU 0.002574 0.42821 9.38511
204 4Q3F TLA 0.009827 0.40366 9.40171
205 2DWU DGL 0.00455 0.40155 9.42029
206 1H9G COA MYR 0.006879 0.40574 9.46502
207 3UEC ALA ARG TPO LYS 0.002505 0.43622 9.58904
208 2BZ1 TAU 0.008308 0.44412 9.69388
209 3BY8 MLT 0.0002919 0.47805 9.85915
210 2Q1A 2KT 0.00336 0.42381 9.89761
211 3JDW ORN 0.0008356 0.4241 9.93789
212 2Q37 3AL 0.0005845 0.44925 9.94475
213 2X61 CH 0.0127 0.409 10.0775
214 2Q3M MLA 0.00772 0.42829 10.1227
215 1U7Z PMT 0.001985 0.43536 10.177
216 1L1Q 9DA 0.0003826 0.44361 10.2151
217 2XDQ MGX 0.02085 0.40715 10.2484
218 3CXO 1N5 0.009988 0.40459 10.2484
219 3U5S FAD 0.002104 0.41748 10.3175
220 2WE5 ADP 0.0006693 0.42519 10.3226
221 4TMK T5A 0.02741 0.4283 10.3286
222 2W3L DRO 0.01861 0.40957 10.4167
223 1WGC SIA GAL BGC 0.02045 0.41481 10.5263
224 3QV9 QV7 0.002456 0.42333 10.559
225 3DAG FEG 0.004855 0.4102 10.6145
226 4M2K PLP 0.0005192 0.41401 10.8696
227 3H86 AP5 0.02384 0.40767 10.9375
228 3WUD GLC GAL 0.01734 0.40444 11.0294
229 3N5O GSH 0.001386 0.42038 11.0638
230 1LNX URI 0.00975 0.41549 11.1111
231 3I0O SMI 0.00613 0.40678 11.1801
232 4NAO AKG 0.01134 0.40676 11.1801
233 3QDW NDG 0.002164 0.43907 11.1888
234 3QDY CBS 0.002519 0.43611 11.1888
235 3QDY A2G GAL 0.004561 0.43162 11.1888
236 3QDW A2G 0.006935 0.43056 11.1888
237 3QDT A2G GAL 0.009219 0.41732 11.1888
238 4LSJ LSJ 0.005755 0.4008 11.2403
239 1LYX PGA 0.001747 0.40024 11.2903
240 1FDJ 2FP 0.001894 0.40612 11.2948
241 1BTN I3P 0.00705 0.45515 11.3208
242 3RGG AIR 0.003542 0.40085 11.3208
243 2BO4 FLC 0.007049 0.41605 11.335
244 1C3V PDC 0.006506 0.40571 11.4286
245 1I1Q TRP 0.003717 0.40497 11.4583
246 3CEV ARG 0.004933 0.40019 11.7057
247 1AX2 NDG GAL 0.00273 0.41559 11.7155
248 1QB7 ADE 0.002868 0.40429 11.8644
249 2YBQ UP2 0.0002409 0.47644 11.9863
250 4GO7 THR 0.0009768 0.42187 12
251 4BMO FMN 0.002324 0.42271 12.605
252 1TU3 GNP 0.001461 0.43058 12.6582
253 1YAG ATP 0.000751 0.43836 12.8
254 2BGM NAJ 0.01083 0.42499 12.9496
255 2HVW DDN 0.002092 0.40701 13.0435
256 4F8L GAL 0.002456 0.47252 13.1034
257 1ZJ6 G3D 0.0005565 0.42547 13.369
258 2VQ5 HBA 0.001649 0.44436 13.4328
259 2VQ5 LDP 0.01068 0.4214 13.4328
260 4G28 0W8 0.002408 0.41229 13.7255
261 3VPQ GSH 0.005888 0.40751 13.7255
262 1JH7 UVC 0.008815 0.4002 13.7566
263 1V2X SAM 0.002358 0.4137 13.9175
264 1PR9 NAP 0.005159 0.41859 13.9344
265 3D3W NAP 0.006605 0.4118 13.9344
266 1P9B HDA 0.005628 0.40833 13.9752
267 2PWY SAH 0.003528 0.41241 14.3411
268 2HW1 FRU 0.006623 0.40539 14.7651
269 1KC7 PPR 0.002964 0.43294 14.9068
270 2BOI MFU 0.001045 0.43233 15.0442
271 1ZGA SAH 0.00316 0.40043 15.126
272 1H2M OGA 0.0013 0.44161 15.3846
273 1JN2 SFP 0.02138 0.43242 15.6118
274 3R35 4CO 0.007583 0.4094 15.894
275 1SC3 MLI 0.006323 0.42499 15.9091
276 1PTR PRB 0.003659 0.42884 16
277 1OFH ADP 0.03085 0.4058 16.092
278 1Z42 HBA 0.02147 0.4217 16.1491
279 1Z44 NPO 0.03354 0.41138 16.1491
280 3HY3 10F 0.006433 0.40231 16.2562
281 1PVS 7HP 0.01305 0.40702 17.3759
282 2VKL MLT 0.002043 0.46598 17.7778
283 2W1A TSA 0.001261 0.40539 17.7778
284 1R18 SAH 0.003232 0.41216 18.0617
285 2GJ3 FAD 0.002847 0.41428 19.1667
286 2P4T NAP 0.005153 0.41613 20.9677
287 1H8P PC 0.02615 0.4023 22.0183
288 1ULE GLA GAL NAG 0.0009619 0.46317 23.3333
289 3I6B KDO 0.002598 0.41646 23.8889
290 1ECM TSA 0.001623 0.41894 25.6881
291 1C1L GAL BGC 0.001153 0.45133 29.1971
292 2FOI JPA 0.001991 0.41025 30
293 1H8G CHT 0.001195 0.48929 34.7368
294 1JAC AMG 0.01184 0.427 35
295 1UO5 PIH 0.0135 0.43277 41.1765
296 1UO4 PIH 0.01752 0.41826 44.1176
Pocket No.: 3; Query (leader) PDB : 3W2W; 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: 3w2w.bio1) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3W2W; Ligand: ATP; 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: 3w2w.bio1) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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