Receptor
PDB id Resolution Class Description Source Keywords
4ZS4 2.4 Å EC: 2.7.11.7 CRYSTAL STRUCTURE OF THE INACTIVE ALPHA-KINASE DOMAIN OF MYO HEAVY CHAIN KINASE A (D756A) COMPLEXED WITH ATP DICTYOSTELIUM DISCOIDEUM PROTEIN KINASE LIKE FOLD ATYPICAL SER/THR PROTEIN KINASES TRANSFERASE
Ref.: CHARACTERIZATION OF THE CATALYTIC AND NUCLEOTIDE BI PROPERTIES OF THE ALPHA-KINASE DOMAIN OF DICTYOSTEL MYOSIN-II HEAVY CHAIN KINASE A. J.BIOL.CHEM. V. 290 23935 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ZN B:902;
A:902;
Part of Protein;
Part of Protein;
none;
none;
submit data
65.409 Zn [Zn+2...
PO4 B:901;
A:901;
Invalid;
Invalid;
none;
none;
submit data
94.971 O4 P [O-]P...
ATP B:903;
A:903;
Valid;
Valid;
none;
none;
Kd = 20 uM
507.181 C10 H16 N5 O13 P3 c1nc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4ZS4 2.4 Å EC: 2.7.11.7 CRYSTAL STRUCTURE OF THE INACTIVE ALPHA-KINASE DOMAIN OF MYO HEAVY CHAIN KINASE A (D756A) COMPLEXED WITH ATP DICTYOSTELIUM DISCOIDEUM PROTEIN KINASE LIKE FOLD ATYPICAL SER/THR PROTEIN KINASES TRANSFERASE
Ref.: CHARACTERIZATION OF THE CATALYTIC AND NUCLEOTIDE BI PROPERTIES OF THE ALPHA-KINASE DOMAIN OF DICTYOSTEL MYOSIN-II HEAVY CHAIN KINASE A. J.BIOL.CHEM. V. 290 23935 2015
Members (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3LMI - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 3LKM - AMP C10 H14 N5 O7 P c1nc(c2c(n....
3 3LMH - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
4 4ZS4 Kd = 20 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
5 4ZMF Kd = 160 uM AMP C10 H14 N5 O7 P c1nc(c2c(n....
6 4ZME Kd = 45 uM ADN C10 H13 N5 O4 c1nc(c2c(n....
7 5DYJ - AMP C10 H14 N5 O7 P c1nc(c2c(n....
8 5E9E - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
9 3LLA - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
70% Homology Family (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3LMI - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 3LKM - AMP C10 H14 N5 O7 P c1nc(c2c(n....
3 3LMH - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
4 4ZS4 Kd = 20 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
5 4ZMF Kd = 160 uM AMP C10 H14 N5 O7 P c1nc(c2c(n....
6 4ZME Kd = 45 uM ADN C10 H13 N5 O4 c1nc(c2c(n....
7 5DYJ - AMP C10 H14 N5 O7 P c1nc(c2c(n....
8 5E9E - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
9 3LLA - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
10 3PDT - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
50% Homology Family (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3LMI - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 3LKM - AMP C10 H14 N5 O7 P c1nc(c2c(n....
3 3LMH - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
4 4ZS4 Kd = 20 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
5 4ZMF Kd = 160 uM AMP C10 H14 N5 O7 P c1nc(c2c(n....
6 4ZME Kd = 45 uM ADN C10 H13 N5 O4 c1nc(c2c(n....
7 5DYJ - AMP C10 H14 N5 O7 P c1nc(c2c(n....
8 5E9E - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
9 3LLA - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
10 3PDT - ADP C10 H15 N5 O10 P2 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 : 4ZS4; Ligand: ATP; Similar sites found: 379
This union binding pocket(no: 1) in the query (biounit: 4zs4.bio1) has 21 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5IGI ZIT 0.01996 0.40172 0.996678
2 5IGI GMP 0.01897 0.40172 0.996678
3 4Y93 746 0.00002104 0.52011 1.30293
4 5JFS 6K0 0.0001591 0.50143 1.30293
5 5IH1 GDP 0.01769 0.414 1.3245
6 5IH1 6BQ 0.01769 0.414 1.3245
7 5FBN 5WF 0.0000516 0.51697 1.47601
8 5HVJ ANP 0.00001837 0.56954 1.62866
9 3MVH WFE 0.00002828 0.52216 1.62866
10 4LH7 1X8 0.000645 0.49015 1.62866
11 3LXK MI1 0.0001566 0.4853 1.62866
12 3FHR P4O 0.0004045 0.45335 1.62866
13 4IGH ORO 0.03487 0.40899 1.62866
14 4IGH 1EA 0.03487 0.40899 1.62866
15 4IGH FMN 0.03487 0.40899 1.62866
16 4LY9 1YY 0.02308 0.40685 1.62866
17 4LY9 S6P 0.02933 0.40105 1.62866
18 5HX8 66P 0.0001186 0.43837 1.65563
19 3VPB ADP 0.0002416 0.47332 1.77305
20 3VPC ADP 0.0003233 0.44186 1.77305
21 4TWP AXI 0.0001925 0.50237 1.84502
22 5H2U 1N1 0.0006455 0.43942 1.87266
23 5DA3 58V 0.00001722 0.54512 1.88679
24 3PE2 E1B 0.000001028 0.61069 1.9544
25 3ALN ANP 0.000003244 0.54605 1.9544
26 3ORK AGS 0.000000158 0.54317 1.9544
27 4GYI ADP 0.0001156 0.49891 1.9544
28 3I0O ADP 0.0005969 0.47094 1.9544
29 3KRL KRL 0.0005128 0.45317 1.9544
30 5TDF ADP 0.0005859 0.4486 1.9544
31 5EKO N17 0.001341 0.43691 1.9544
32 5VZ0 ADP 0.0008256 0.43007 1.9544
33 4PU5 ANP 0.0006992 0.42505 1.9544
34 4MV1 ADP 0.006204 0.41942 1.9544
35 4A4X JUP 0.00002466 0.51912 2.15054
36 5M06 ADP 0.000009706 0.50134 2.17391
37 4XLI 1N1 0.0005873 0.43637 2.23881
38 1Q8Y ADP 0.000001088 0.56654 2.28013
39 4QTB 38Z 0.000006543 0.54879 2.28013
40 4YZC STU 0.00001264 0.54807 2.28013
41 3NW7 LGV 0.00003017 0.54147 2.28013
42 3X01 AMP 0.0001606 0.51529 2.28013
43 2B9F ADP 0.00002456 0.49874 2.28013
44 2B9I ADP 0.00005244 0.49688 2.28013
45 2B9H ADP 0.00005473 0.49063 2.28013
46 2B9J ADP 0.00003282 0.48766 2.28013
47 2X2M X2M 0.00008524 0.48703 2.28013
48 1Q8Y ADE 0.00001409 0.46563 2.28013
49 5BYZ 4WE 0.0009196 0.45563 2.28013
50 5DH3 5BS 0.0005529 0.44968 2.28013
51 4AUA 4AU 0.0004029 0.44379 2.28013
52 4OYA 1VE 0.006862 0.44267 2.28013
53 4NFN 2KC 0.000418 0.44161 2.28013
54 2Q7D ANP 0.001794 0.43651 2.28013
55 3E8N ATP 0.000000953 0.42183 2.28013
56 3E8N VRA 0.000000953 0.42183 2.28013
57 4AZW ATP 0.002873 0.41876 2.28013
58 3V4S ADP 0.009066 0.41546 2.28013
59 3V4S ATP 0.004189 0.41351 2.28013
60 3VRY B43 0.0008185 0.41119 2.28013
61 1K3A ACP 0.00001493 0.49129 2.34114
62 3PLS ANP 0.0000005011 0.56217 2.34899
63 4KS7 X4Z 0.0000002286 0.55904 2.39726
64 4Z4P SAH 0.006387 0.40901 2.40964
65 5C4L SIS 0.0001357 0.49317 2.49221
66 5C4L 4XR 0.0002134 0.48429 2.49221
67 5K2M ADP 0.0004429 0.45985 2.5641
68 2HK5 1BM 0.0009395 0.43974 2.59259
69 2A1L PCW 0.01846 0.40896 2.59259
70 5LI1 ANP 0.0000001913 0.60209 2.60586
71 2PYW ADP 0.000001955 0.55555 2.60586
72 5LI9 ACP 0.000001697 0.55537 2.60586
73 2YAB AMP 0.000002162 0.55086 2.60586
74 3EKK GS2 0.00001207 0.54899 2.60586
75 3TKI S25 0.00006834 0.53132 2.60586
76 5I35 ANP 0.000003633 0.5275 2.60586
77 5UIU 8CG 0.00004542 0.5129 2.60586
78 5U6C 7YS 0.00002957 0.507 2.60586
79 4OAV ACP 0.00001099 0.50603 2.60586
80 2HY0 306 0.0001493 0.49369 2.60586
81 1I7L ATP 0.0000969 0.48884 2.60586
82 2V58 LZJ 0.0003783 0.48857 2.60586
83 4ANW O92 0.0004014 0.4734 2.60586
84 2VQD AP2 0.0001186 0.46924 2.60586
85 3V8S 0HD 0.0001621 0.46066 2.60586
86 3ORQ ADP 0.0003218 0.45984 2.60586
87 5T8O 76Z 0.0001948 0.45825 2.60586
88 5AX9 4KT 0.0002326 0.4577 2.60586
89 4U44 3D9 0.0003144 0.45315 2.60586
90 1CM8 ANP 0.0003888 0.44662 2.60586
91 3WVR AMP 0.0003396 0.44172 2.60586
92 1PK8 ATP 0.0001371 0.43991 2.60586
93 1ZB6 DIN 0.004789 0.4205 2.60586
94 1ZB6 GST 0.005142 0.4205 2.60586
95 4DC2 ADE 0.000157 0.40553 2.60586
96 3SXS PP2 0.00007648 0.48679 2.61194
97 3TDV GDP 0.000008189 0.53225 2.61438
98 3BU5 ATP 0.00001027 0.51576 2.61438
99 5MJA 7O3 0.000763 0.42676 2.62295
100 2VN9 GVD 0.000003149 0.49491 2.65781
101 4BTK DTQ 0.0002984 0.45334 2.67062
102 2XMY CDK 0.0001467 0.5245 2.68456
103 1TQP ATP 0.000006392 0.49612 2.83688
104 1BYG STU 0.00001074 0.49984 2.8777
105 2WQN ADP 0.0000001604 0.63323 2.9316
106 4H3Q ANP 0.00000007507 0.62266 2.9316
107 3QCQ 3Q0 0.00007693 0.55104 2.9316
108 5TA6 79D 0.00001384 0.53227 2.9316
109 4K33 ACP 0.000006732 0.52969 2.9316
110 5BVE 4VG 0.0001334 0.52395 2.9316
111 4H3P ANP 0.000006949 0.52263 2.9316
112 4OTH DRN 0.00001654 0.51796 2.9316
113 5LVP ATP 0.000005413 0.50692 2.9316
114 3IGO ANP 0.00001606 0.49751 2.9316
115 5JKG 6LF 0.0001893 0.49533 2.9316
116 4OCJ NDG 0.000194 0.49483 2.9316
117 4IJP 1EH 0.00006705 0.48925 2.9316
118 3FC2 IBI 0.001166 0.48189 2.9316
119 4EUU BX7 0.0002402 0.47526 2.9316
120 4L9I 8PR 0.0001387 0.46505 2.9316
121 3GC0 AMP 0.00008217 0.46103 2.9316
122 4I6H 1C8 0.0002116 0.45967 2.9316
123 4X7Q 3YR 0.0005762 0.45123 2.9316
124 3OFM 4B0 0.0002297 0.44495 2.9316
125 3GC8 B45 0.0002862 0.44342 2.9316
126 4DFU QUE 0.004038 0.44096 2.9316
127 3C1X CKK 0.0004751 0.43523 2.9316
128 3ETH ATP 0.002504 0.42324 2.9316
129 3W0O ADP 0.0003706 0.40583 2.9316
130 3W0O HY0 0.0003706 0.40583 2.9316
131 4L3L 5FI 0.000129 0.49252 2.96053
132 1ZY5 ANP 0.0006925 0.43484 2.9703
133 4I94 ANP 0.0002295 0.45199 3
134 3HAV ATP 0.0007897 0.40552 3.01003
135 2ZV2 609 0.0001368 0.50177 3.02013
136 3SM2 478 0.00699 0.42396 3.0303
137 2WEI VGG 0.00006642 0.46871 3.13589
138 1UPR 4IP 0.03881 0.40001 3.25203
139 1OUK 084 0.0001586 0.54295 3.25733
140 4FG8 ATP 0.000004944 0.53815 3.25733
141 5LXC 7AA 0.000001587 0.53405 3.25733
142 2F57 23D 0.000008244 0.50406 3.25733
143 4LOO SB4 0.0001095 0.47121 3.25733
144 1DZK PRZ 0.0009612 0.44595 3.25733
145 3DLS ADP 0.0003346 0.44361 3.25733
146 4U0I 0LI 0.004466 0.42461 3.25733
147 2XVD AS6 0.00003038 0.51893 3.31126
148 1W2D ADP 0.003312 0.43506 3.39623
149 5MW8 ATP 0.0000002832 0.59747 3.39703
150 1U59 STU 0.00001504 0.52068 3.48432
151 3RI1 3RH 0.000004948 0.55006 3.58306
152 4YLL 4E3 0.000006161 0.53904 3.58306
153 3UIM ANP 0.00002687 0.49793 3.58306
154 5MRH Q9Z 0.0009915 0.46594 3.58306
155 2VPQ ANP 0.0003902 0.46034 3.58306
156 3DNT ATP 0.001792 0.43318 3.58306
157 5CKW ANP 0.0003076 0.43304 3.58306
158 3VSV XYS 0.007641 0.43072 3.58306
159 3C0G 3AM 0.0005847 0.42675 3.58306
160 3VOT ADP 0.0006819 0.41569 3.58306
161 3TPV ADE 0.003532 0.41293 3.58306
162 5TVM PUT 0.01556 0.40592 3.58306
163 5GZ9 ANP 0.000003005 0.55267 3.60656
164 3SLS ANP 0.0000005269 0.58297 3.61842
165 4USF 6UI 0.0006802 0.45167 3.61842
166 4AU8 Z3R 0.0002459 0.43513 3.71622
167 4N1T 2GD 0.004329 0.4278 3.77358
168 5DRB 5FJ 0.0000005562 0.62328 3.78007
169 3ZJX BOG 0.001646 0.46423 3.80623
170 1V0O INR 0.0001558 0.47113 3.81944
171 5HA0 LTD 0.01128 0.401 3.84615
172 4CRL C1I 0.0007616 0.46218 3.85965
173 1ZP9 ATP 0.00005081 0.47381 3.87597
174 1ZTH ADP 0.00009231 0.45176 3.87597
175 3RE4 TO1 0.0005397 0.43909 3.87597
176 5LXM ADP 0.0000127 0.50486 3.88693
177 4QMN DB8 0.00001 0.55117 3.90879
178 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 0.00004549 0.54286 3.90879
179 2JDR L20 0.00004549 0.54286 3.90879
180 5UR1 YY9 0.00003562 0.5343 3.90879
181 5IH9 6BF 0.00006268 0.51461 3.90879
182 4OCV ANP 0.00002876 0.50262 3.90879
183 3KN5 ANP 0.0001055 0.45351 3.90879
184 2WSA 646 0.008985 0.44625 3.90879
185 2WSA MYA 0.008985 0.44625 3.90879
186 4NW6 2NS 0.00001366 0.44259 3.90879
187 2IO8 ADP 0.0002271 0.43725 3.90879
188 2YNE NHW 0.01802 0.43143 3.90879
189 2YNE YNE 0.01802 0.43143 3.90879
190 1IOW ADP 0.004692 0.42743 3.92157
191 1IOW PHY 0.004692 0.42743 3.92157
192 2OFV 242 0.002262 0.44318 3.97112
193 4JR7 GNP 0.00001077 0.51511 4.01069
194 4O4F IHP 0.009012 0.40534 4.03226
195 5EW9 5VC 0.0001651 0.54204 4.05904
196 3E5A VX6 0.00007382 0.45021 4.10448
197 4XIZ LPP 0.01223 0.40719 4.11765
198 2Y6O 1N1 0.000397 0.458 4.12371
199 2VZ6 FEF 0.0002122 0.48652 4.15335
200 4BFM ANP 0.00000007202 0.61746 4.23453
201 4FL3 ANP 0.0000002232 0.59918 4.23453
202 3UDZ ADP 0.0000001628 0.59906 4.23453
203 4Y0X ADP 0.0000001712 0.57336 4.23453
204 4JDI ANP 0.0000009529 0.56903 4.23453
205 4FE2 ADP 0.00001281 0.54382 4.23453
206 2PZI AXX 0.00002905 0.52711 4.23453
207 3SXF BK5 0.00003152 0.52675 4.23453
208 3AKK ADP 0.00005944 0.48909 4.23453
209 4BHN BH9 0.000115 0.47913 4.23453
210 5UOX 8GY 0.0001459 0.47688 4.23453
211 4ASE AV9 0.001492 0.44167 4.23453
212 5W2I ADP 0.006116 0.40973 4.28016
213 5W2I I3P 0.006116 0.40973 4.28016
214 4CSV STI 0.006611 0.4066 4.36364
215 2X4Z X4Z 0.000001164 0.59219 4.39189
216 5HQ0 LZ9 0.0001119 0.47965 4.3956
217 1GT4 UNA 0.001572 0.41868 4.40252
218 5EFQ ADP 0.00001692 0.50658 4.47761
219 5USZ SKE 0.00001004 0.53848 4.49827
220 4YZN 4K5 0.00000201 0.56029 4.52962
221 2BKK ADP 0.001886 0.41082 4.54545
222 3TXO 07U 0.0002464 0.44667 4.56026
223 1M0W ANP 0.001803 0.41043 4.56026
224 3AVR OGA 0.02309 0.40327 4.56026
225 2A19 ANP 0.00000595 0.56736 4.57746
226 1IIU RTL 0.00437 0.41271 4.5977
227 4YMJ 4EJ 0.00015 0.5171 4.60526
228 5CEO 50D 0.00002445 0.49948 4.66667
229 1YQC GLV 0.01916 0.41999 4.70588
230 4XV1 904 0.0002285 0.48599 4.79452
231 1UNH IXM 0.00005709 0.46465 4.80769
232 5VC5 96M 0.00002963 0.51753 4.84429
233 4N70 2HX 0.00003222 0.5425 4.88599
234 2RIO ADP 0.000001688 0.54057 4.88599
235 4P5Z Q7M 0.00004175 0.52565 4.88599
236 3CY2 MB9 0.000202 0.47284 4.88599
237 5HES 032 0.0002389 0.46758 4.88599
238 4R78 AMP 0.003676 0.43778 4.88599
239 4G17 0VN 0.0005108 0.43132 4.88599
240 1T36 ADP 0.005361 0.41687 4.88599
241 3GGF GVD 0.000493 0.43486 4.98339
242 4CQE CQE 0.000235 0.4679 5.03597
243 3SRV S19 0.000008754 0.51306 5.05415
244 2V7O DRN 0.000001952 0.50285 5.05952
245 5L8L ADP 0.00002072 0.4763 5.12821
246 2AQX ATP 0.003747 0.41562 5.19031
247 4WNK 453 0.000007334 0.54851 5.21173
248 5MY8 RXZ 0.000005651 0.54532 5.21173
249 3LXN MI1 0.00001113 0.51098 5.21173
250 3M2W L8I 0.00004973 0.46908 5.21173
251 4E93 GUI 0.00001987 0.43672 5.21173
252 4FFG 0U8 0.01738 0.40744 5.21173
253 3OND NAD 0.02546 0.40637 5.21173
254 3OND ADN 0.02546 0.40637 5.21173
255 4C2C ALA VAL PRO ALA 0.007758 0.40008 5.21173
256 2R0D 4IP 0.02118 0.40001 5.21173
257 4WNP 3RJ 0.00004004 0.4712 5.22648
258 4GJ3 0XP 0.0001171 0.49605 5.29801
259 5A6N U7E 0.00000109 0.56362 5.30035
260 4IAW LIZ 0.01413 0.4046 5.31915
261 4OUC 5ID 0.0003096 0.44025 5.32213
262 4LRJ ANP 0.0000006873 0.55495 5.32544
263 1PHK ATP 0.00001042 0.52155 5.36913
264 5A5W GUO 0.02286 0.40187 5.5336
265 5DBX ANP 0.0000001525 0.56222 5.53746
266 2WU6 DKI 0.00001529 0.5218 5.53746
267 5N87 N66 0.0002247 0.48918 5.53746
268 3HMO STU 0.00005311 0.47906 5.53746
269 4CYI ATP 0.002649 0.42028 5.53746
270 2CFM AMP 0.007376 0.41826 5.53746
271 1OBD ATP 0.0000464 0.47011 5.55556
272 5C1P ADP 0.002009 0.40265 5.55556
273 5C1P DAL DAL 0.01013 0.4016 5.55556
274 2YAK OSV 0.0000005265 0.59995 5.61404
275 5JZJ AN2 0.00000233 0.53622 5.72391
276 1QY1 PRZ 0.001183 0.43739 5.74713
277 5HCY 60D 0.000002229 0.59204 5.86319
278 4IX4 ADP 0.000317 0.46012 5.86319
279 3PP0 03Q 0.0004048 0.41446 5.86319
280 4AT3 LTI 0.0003242 0.40369 5.86319
281 3G5D 1N1 0.0002382 0.50724 5.94406
282 4D2S DYK 0.0005173 0.42426 5.98592
283 4M69 ANP 0.0000003422 0.58823 6.00707
284 5KO1 6UY 0.0001511 0.4624 6.00707
285 4O1P ANP 0.000003263 0.53651 6.18893
286 2H8H H8H 0.0001765 0.46346 6.18893
287 1Y57 MPZ 0.0001274 0.4539 6.18893
288 4Q5H ANP 0.00001612 0.5082 6.32184
289 4CS9 AMP 0.003841 0.43892 6.34921
290 4CLI 5P8 0.000007781 0.56657 6.51466
291 5IQD GNP 0.0008194 0.46469 6.51466
292 5IQD RIO 0.0008719 0.46469 6.51466
293 4Y85 499 0.001168 0.42451 6.51466
294 3QH2 3NM 0.02547 0.40012 6.51466
295 4XMF HSM 0.0002142 0.52672 6.52174
296 2R5T ANP 0.00003141 0.48575 6.70241
297 1EPB REA 0.00639 0.409 6.70732
298 3O0G 3O0 0.00004798 0.48007 6.71141
299 3HZT J60 0.00007126 0.51541 6.84039
300 5X8I SQZ 0.00001781 0.50657 6.84039
301 5LPZ ADP 0.00001692 0.50638 6.84039
302 3KRR DQX 0.0005819 0.49442 6.84039
303 4IDT T28 0.0001126 0.46569 6.84039
304 4OH4 ANP 0.000223 0.45988 6.84039
305 4GLW 0XT 0.0009748 0.40543 6.88525
306 3GQI ACP 0.00003684 0.50361 7.05521
307 5DEY 59T 0.00001443 0.56368 7.07071
308 2CSN CKI 0.003807 0.45085 7.07071
309 5LPB ADP 0.00008344 0.45425 7.09459
310 1XJD STU 0.000196 0.46685 7.16612
311 1UNQ 4IP 0.01009 0.42285 7.2
312 4WW7 AMP 0.00004132 0.50069 7.27969
313 5JGA 6KC 0.0001272 0.49603 7.30159
314 2PVF ACP 0.00002145 0.52003 7.49186
315 5VCV 1N1 0.00002309 0.5162 7.49186
316 2PVN P63 0.000002516 0.56737 7.67045
317 3GNI ATP 0.00001099 0.52317 7.81759
318 4NST ADP 0.00003386 0.49382 7.81759
319 4XYM A12 0.001087 0.43491 8.14332
320 2PUL ACP 0.009442 0.41789 8.14332
321 5TO8 7FM 0.0001871 0.49688 8.15603
322 1U5R ATP 0.0000198 0.51544 8.46906
323 5W4W 9WG 0.00004649 0.51417 8.46906
324 4KBA 1QM 0.0002704 0.41477 8.46906
325 5EYK 5U5 0.000009297 0.53997 8.47458
326 2WEL K88 0.00002903 0.44015 8.66667
327 4EWH T77 0.00003286 0.44607 8.72727
328 4WB6 ATP 0.0000005994 0.59073 8.79479
329 2Z7R STU 0.000003291 0.54842 8.79479
330 5C03 AGS 0.00002561 0.49824 8.79479
331 4WB7 ATP 0.00002214 0.42177 8.79479
332 2QCS ANP 0.0000005104 0.59383 9.12052
333 3FHI ANP 0.0000005945 0.59089 9.12052
334 1RE8 BD2 0.0001766 0.50527 9.12052
335 2GU8 796 0.000322 0.50095 9.12052
336 3IDB ANP 0.00006244 0.46648 9.12052
337 4E1Z 0MX 0.0001589 0.45071 9.27835
338 3KMW ATP 0.0002189 0.45483 9.30233
339 4Y8D 49J 0.0002005 0.47134 9.44625
340 4AZT LY2 0.0006511 0.41022 9.44625
341 4WOV 3SM 0.0002577 0.48255 9.46372
342 5G1X ADP 0.000006035 0.51733 9.52381
343 4BCN T9N 0.00008612 0.50492 9.54198
344 4CFU 2WC 0.00006715 0.50373 9.54198
345 4BCQ TJF 0.0002863 0.43243 9.54198
346 4BCM T7Z 0.0003045 0.4164 9.54198
347 5LMK 6ZK 0.001107 0.42091 9.68992
348 5UKL SIX 0.000005616 0.54973 9.77199
349 3PVW QRX 0.00002787 0.46015 9.77199
350 4F4P 0SB 0.0002169 0.51195 9.89011
351 3Q60 ATP 0.0000001838 0.57947 10.4235
352 4WHZ 3NL 0.0001417 0.51199 10.4235
353 2Z49 AMG 0.001053 0.46276 10.4235
354 3TTI KBI 0.00003089 0.45132 10.4235
355 3PTG 932 0.0007387 0.4111 10.4235
356 1VJY 460 0.00002578 0.52745 10.5611
357 2JLD AG1 0.000009881 0.54808 10.7492
358 3ZRM ZRM 0.00005977 0.48365 10.7492
359 3F7Z 34O 0.0001125 0.47181 10.7492
360 3E7O 35F 0.0009485 0.45646 10.7492
361 4NM5 ADP 0.00896 0.42817 10.7492
362 5DMZ ADP 0.0000002237 0.60082 10.9589
363 3TII ANP 0.00118 0.40871 11.4007
364 4U98 ACP 0.0003432 0.46602 11.7264
365 3KAL ADP 0.001336 0.45107 12.3779
366 2GQR ADP 0.00002242 0.49578 12.6582
367 3DAK ANP 0.000008251 0.50453 12.7586
368 5EOB 5QQ 0.000006727 0.5807 13.0293
369 2GQS ADP 0.00001978 0.49774 13.0802
370 4XH0 ADP 0.00004226 0.54546 14.658
371 5AWM ANP 0.0001033 0.44437 15.3094
372 4UX9 ANP 0.000006486 0.52114 17.5896
373 3K5I ADP 0.005578 0.40629 17.5896
374 3K5I AIR 0.01449 0.40265 17.5896
375 4IZY 1J2 0.00002848 0.49395 17.9153
376 4F9C 0SX 0.0000471 0.48239 20.8333
377 4C2V YJA 0.0001651 0.4877 29.5455
378 1IA9 ANP 0.000000000002289 0.80728 32.1429
379 4C2W ANP 0.00001237 0.48357 32.6923
Pocket No.: 2; Query (leader) PDB : 4ZS4; Ligand: ATP; Similar sites found: 9
This union binding pocket(no: 2) in the query (biounit: 4zs4.bio2) has 21 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1QD1 FON 0.01075 0.40045 1.9544
2 3JQ3 ADP 0.01612 0.40181 3.58306
3 4M26 SIN 0.01087 0.40171 3.90879
4 4M26 ZZU 0.01087 0.40171 3.90879
5 5K13 6Q7 0.007342 0.4029 4.47154
6 4UWJ MYA 0.03209 0.4102 5.21173
7 4UWJ 7L5 0.03209 0.4102 5.21173
8 5NBW 8SK 0.01065 0.40647 6.07477
9 3VKC FPQ 0.003909 0.40019 7.34266
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