Receptor
PDB id Resolution Class Description Source Keywords
4L9I 2.32 Å EC: 2.7.11.14 BOVINE G PROTEIN COUPLED RECEPTOR KINASE 1 IN COMPLEX WITH P BOS TAURUS AGC FAMILY KINASE SER/THR KINASE RGS HOMOLOGY DOMAIN G PRCOUPLED RECEPTOR KINASE GRK GRK1 RHODOPSIN KINASE SSRIHYDROLYASE GPCR PHOSPHORYLATION TRANSFERASE MEMBRANE PRINHIBITOR COMPLEX
Ref.: STRUCTURAL AND FUNCTIONAL ANALYSIS OF G PROTEIN-COU RECEPTOR KINASE INHIBITION BY PAROXETINE AND A RATI DESIGNED ANALOG. MOL.PHARMACOL. V. 85 237 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
8PR A:601;
B:601;
Valid;
Valid;
none;
none;
Kd = 13 uM
329.365 C19 H20 F N O3 c1cc(...
CL B:602;
B:603;
Invalid;
Invalid;
none;
none;
submit data
35.453 Cl [Cl-]
MES A:602;
Invalid;
none;
submit data
195.237 C6 H13 N O4 S C1COC...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4L9I 2.32 Å EC: 2.7.11.14 BOVINE G PROTEIN COUPLED RECEPTOR KINASE 1 IN COMPLEX WITH P BOS TAURUS AGC FAMILY KINASE SER/THR KINASE RGS HOMOLOGY DOMAIN G PRCOUPLED RECEPTOR KINASE GRK GRK1 RHODOPSIN KINASE SSRIHYDROLYASE GPCR PHOSPHORYLATION TRANSFERASE MEMBRANE PRINHIBITOR COMPLEX
Ref.: STRUCTURAL AND FUNCTIONAL ANALYSIS OF G PROTEIN-COU RECEPTOR KINASE INHIBITION BY PAROXETINE AND A RATI DESIGNED ANALOG. MOL.PHARMACOL. V. 85 237 2014
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 4L9I Kd = 13 uM 8PR C19 H20 F N O3 c1cc(ccc1[....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4PNI ic50 = 0.125 uM KQQ C27 H32 N8 O3 S CC1(CCN(c2....
2 3C4Z - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 4L9I Kd = 13 uM 8PR C19 H20 F N O3 c1cc(ccc1[....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4PNI ic50 = 0.125 uM KQQ C27 H32 N8 O3 S CC1(CCN(c2....
2 3C4Z - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
3 4L9I Kd = 13 uM 8PR C19 H20 F N O3 c1cc(ccc1[....
4 4TNB - SGV C12 H15 N5 O5 c1c(c2c(nc....
5 4TND - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
6 4WNK ic50 = 0.38 uM 453 C26 H22 F N7 O3 CC1=C([C@@....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 8PR; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 8PR 1 1
2 29X 0.571429 0.766667
3 SIX 0.528302 0.764706
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4L9I; Ligand: 8PR; Similar sites found: 345
This union binding pocket(no: 1) in the query (biounit: 4l9i.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5MW8 ATP 0.000039 0.51547 1.69851
2 5BU2 AMP 0.02338 0.40137 1.76211
3 5I35 ANP 0.001006 0.44057 1.78117
4 3UDZ ADP 0.0001492 0.48224 1.82556
5 5K2M ADP 0.008805 0.40963 1.8315
6 1VRP IOM 0.01898 0.40135 1.83727
7 2GJP MAL 0.01394 0.40031 1.85567
8 4OUC 5ID 0.00001444 0.52881 2.2409
9 5XDT MB3 0.007956 0.42388 2.27273
10 5C1P ADP 0.004842 0.40187 2.28758
11 4LY9 1YY 0.007004 0.44119 2.38095
12 4LY9 S6P 0.006481 0.44119 2.38095
13 3ORQ ADP 0.004584 0.41741 2.38727
14 5C4L 4XR 0.0001505 0.50144 2.49221
15 5C4L SIS 0.001684 0.45204 2.49221
16 1IA9 ANP 0.00123 0.42651 2.5
17 2RCU BUJ 0.03472 0.40845 2.57937
18 1A0T SUC 0.0117 0.4136 2.66344
19 4FE2 AIR 0.0005439 0.46823 2.7451
20 4FE2 ADP 0.009043 0.40588 2.7451
21 4LH7 1X8 0.01358 0.41457 2.78638
22 2VQD AP2 0.002197 0.40951 2.80172
23 3ETH ATP 0.00369 0.42352 2.8169
24 2VPQ ANP 0.002638 0.43195 2.88248
25 4ZS4 ATP 0.0001387 0.46505 2.9316
26 1OBD ATP 0.001569 0.42074 2.94118
27 2QHS OCA 0.009997 0.40795 2.95359
28 3EW2 BTN 0.00709 0.41509 2.96296
29 5MRH Q9Z 0.0002616 0.48971 2.97619
30 1PS9 FAD 0.02893 0.40468 2.97619
31 3V4S ATP 0.007834 0.40864 3.1746
32 4OYA 1VE 0.01051 0.4403 3.19149
33 1I7L ATP 0.005735 0.4182 3.23625
34 3PDT ADP 0.001291 0.42952 3.27273
35 5GZ9 ANP 0.00001108 0.54041 3.27869
36 2QHV OC9 0.007443 0.4186 3.33333
37 5VZ0 ADP 0.001166 0.43773 3.37302
38 1T36 ADP 0.007487 0.41739 3.40314
39 4FFG LBS 0.004328 0.43168 3.45528
40 4XYM A12 0.009687 0.40087 3.47826
41 2VDF OCT 0.008847 0.41973 3.55731
42 4R78 AMP 0.01555 0.40288 3.55987
43 3HAV ATP 0.002098 0.45316 3.67893
44 4GYI ADP 0.0002077 0.48206 3.77834
45 3WVR AMP 0.004793 0.41451 3.80313
46 3I0O ADP 0.002249 0.43888 3.83481
47 3TDV GDP 0.00002873 0.49876 3.92157
48 2V58 LZJ 0.004302 0.44634 4.00891
49 1MJT ITU 0.03248 0.40588 4.03458
50 5IXG OTP 0.03199 0.40502 4.14201
51 2I4O ATP 0.003123 0.40145 4.14847
52 1ZB6 DIN 0.01302 0.40752 4.23453
53 3VPC ADP 0.000599 0.42471 4.25532
54 1YXM ADE 0.008487 0.42362 4.29043
55 4AZT LY2 0.004925 0.42264 4.36508
56 3W21 AKG 0.01536 0.41365 4.3956
57 1IY8 NAD 0.01643 0.40649 4.49438
58 4NS0 PIO 0.004235 0.42869 4.51128
59 2Z49 AMG 0.00212 0.45412 4.62963
60 4AZW ATP 0.005815 0.41274 4.67091
61 4OAV ACP 0.000002602 0.55513 4.7619
62 2IVD ACJ 0.009714 0.40855 4.7619
63 2PUL ACP 0.01359 0.41703 4.96032
64 2QX0 PH2 0.01866 0.40516 5.03145
65 2PYW ADP 0.0001176 0.48923 5.2381
66 2GQS C2R 0.0002055 0.47654 5.48523
67 2GQS ADP 0.001414 0.43402 5.48523
68 2XG5 EC5 0.003846 0.44401 5.50459
69 2XG5 EC2 0.003846 0.44401 5.50459
70 1N07 FMN 0.02002 0.40355 5.52147
71 3ZJX BOG 0.02058 0.40251 5.88235
72 3KA2 2NC 0.03477 0.40628 5.91133
73 5M6N 7H9 0.02275 0.40021 5.9322
74 4O1P ANP 0.000003536 0.55226 5.95238
75 5XLY C2E 0.004783 0.40357 6.01504
76 4JNJ BTN 0.005615 0.41138 6.08696
77 4MTI 2DX 0.01535 0.40966 6.08696
78 3AKK ADP 0.000819 0.43241 6.15079
79 2D24 XYS XYS 0.02554 0.40165 6.42202
80 4LRJ ANP 0.0000005839 0.58386 6.50888
81 2OVD DAO 0.02239 0.40172 6.59341
82 4XMF HSM 0.0001215 0.53112 7.06522
83 4IX4 ADP 0.0009323 0.44865 7.71429
84 2AG4 LP3 0.006776 0.44798 7.92683
85 2AG4 OLA 0.006679 0.44612 7.92683
86 5ML3 DL3 0.01113 0.42021 8.05369
87 4WVW SLT 0.009901 0.4179 8.33333
88 4WW7 AMP 0.001156 0.44642 8.55615
89 3JU6 ANP 0.02104 0.40065 8.64865
90 2CBT TH2 0.01807 0.404 8.92857
91 4RYV ZEA 0.01377 0.40129 9.03226
92 1ZP9 ATP 0.00007226 0.49711 9.30233
93 1ZTH ADP 0.0009805 0.42681 9.30233
94 3RE4 TO1 0.002913 0.40877 9.30233
95 5IQD GNP 0.0002975 0.49468 10.1639
96 5IQD RIO 0.0003168 0.49468 10.1639
97 5CKW ANP 0.00243 0.41298 10.643
98 4I94 ANP 0.000008648 0.53203 11
99 5W2I I3P 0.00458 0.42268 11.284
100 5W2I ADP 0.00458 0.42268 11.284
101 4CYI ATP 0.0001569 0.48357 11.3095
102 2D6M LBT 0.01604 0.40952 11.3208
103 2PZI AXX 0.0002282 0.48016 11.4537
104 1TZD ADP 0.01158 0.41372 12
105 3VPB ADP 0.0003193 0.47764 12.5
106 5LRT ADP 0.006944 0.41595 12.6984
107 3Q60 ATP 0.000009743 0.52974 12.938
108 5MY8 RXZ 0.000001187 0.5896 13.0952
109 1W2D ADP 0.00211 0.4402 13.2075
110 1TQP ATP 0.0007627 0.41132 13.4921
111 3VHE 42Q 0.000006628 0.44589 14.2061
112 4Q5H ANP 0.00005607 0.49877 14.4737
113 3GQI ACP 0.00000004411 0.61845 14.7239
114 4JR7 GNP 0.000006337 0.54097 14.9733
115 4XH0 ADP 0.0000298 0.54802 15.1365
116 2W5P CL8 0.007616 0.42832 15.4362
117 5JKG 6LF 0.00004523 0.53535 15.7556
118 4F9C 0SX 0.0000004573 0.58856 15.7895
119 4EWH T77 0.000002031 0.47578 16
120 5KO1 6UY 0.0001614 0.47577 16.2544
121 4FL3 ANP 0.0000001356 0.62477 16.8651
122 3H9R TAK 0.00003059 0.53524 18.0556
123 2PVF ACP 0.00000001386 0.65578 18.254
124 1VJY 460 0.00002525 0.53967 18.4524
125 4IJP 1EH 0.00000638 0.54633 18.6508
126 5UR1 YY9 0.0001268 0.51896 18.6508
127 4K33 ACP 0.000000001805 0.70279 18.8492
128 4AUA 4AU 0.0001018 0.48463 18.8492
129 5CEO 50D 0.0000169 0.52198 19
130 3LXN MI1 0.00000003918 0.59319 19.0476
131 4H3Q ANP 0.000004426 0.55858 19.0476
132 4H3P ANP 0.000001645 0.55282 19.0476
133 4GJ3 0XP 0.000005296 0.4453 19.0476
134 4G17 0VN 0.001309 0.43019 19.0909
135 3RI1 3RH 0.0000001806 0.6298 19.1693
136 5BVE 4VG 0.00000004681 0.70917 19.246
137 5BYZ 4WE 0.0000001595 0.64153 19.246
138 4QTB 38Z 0.0000007017 0.60702 19.246
139 4IZY 1J2 0.000006757 0.50609 19.246
140 4Y93 746 0.00007874 0.4355 19.246
141 3KRL KRL 0.00003419 0.46679 19.6429
142 5DMZ ADP 0.0000001341 0.59744 19.8413
143 4E1Z 0MX 0.00000006252 0.55985 19.8413
144 5C03 AGS 0.0008714 0.44566 19.883
145 3OFM 4B0 0.00006416 0.47867 20
146 3VRY B43 0.0002744 0.41767 20.0441
147 4XLI 1N1 0.0007814 0.44543 20.1493
148 4UX9 ANP 0.0000001561 0.57154 20.2381
149 2QLU ADE 0.000001292 0.44918 20.3822
150 2PVN P63 0.00000426 0.57043 20.4545
151 3GC8 B45 0.0003909 0.4338 20.5405
152 4Y0X ADP 0.00005677 0.49015 20.8
153 4WOV 3SM 0.001812 0.43837 20.8202
154 2CSN CKI 0.002047 0.472 20.8754
155 4YZC STU 0.0000001617 0.65123 20.9877
156 2H8H H8H 0.0001725 0.46572 22.0238
157 2WU6 DKI 0.000001182 0.58474 22.0472
158 3IGO ANP 0.000002098 0.51959 22.2222
159 5W4W 9WG 0.0001064 0.50854 22.3565
160 4KBA 1QM 0.003534 0.43445 22.3565
161 1Q8Y ADP 0.00000004603 0.64296 22.5201
162 1Q8Y ADE 0.000002044 0.52096 22.5201
163 4M69 ANP 0.00008215 0.49625 22.6148
164 4E93 GUI 0.00003514 0.41973 23.0769
165 5LXC 7AA 0.0000001609 0.59981 23.2843
166 3TTI KBI 0.000005163 0.4688 23.4127
167 5HES 032 0.0001289 0.48965 23.7785
168 4P5Z Q7M 0.000186 0.5058 24.0997
169 5U6C 7YS 0.0002541 0.43493 24.127
170 1Y57 MPZ 0.00003297 0.46363 24.3363
171 4YMJ 4EJ 0.00008351 0.52453 24.3421
172 2JLD AG1 0.0000004088 0.62631 24.5238
173 4BHN BH9 0.000000508 0.54832 24.6032
174 3C1X CKK 0.0007047 0.42068 24.6649
175 5M06 ADP 0.0000561 0.48916 25
176 3ORK AGS 0.00000005761 0.54237 25.7235
177 3PP0 03Q 0.000101 0.42626 25.7396
178 1OUK 084 0.00008181 0.56851 25.9563
179 4ASE AV9 0.0002812 0.40407 26.0623
180 3PE2 E1B 0.000322 0.50262 26.1128
181 4A4X JUP 0.00003371 0.52465 26.1649
182 5EKO N17 0.001069 0.44988 26.1905
183 2RIO ADP 0.00000001501 0.65425 26.2673
184 3GC0 AMP 0.0001861 0.48427 26.4438
185 4IDT T28 0.0000004945 0.58706 26.6854
186 4BTK DTQ 0.0003776 0.46185 26.7062
187 3PTG 932 0.00005887 0.46626 26.7218
188 4D2S DYK 0.00001308 0.50695 26.7606
189 4LOO SB4 0.0002297 0.47147 26.8698
190 3GNI ATP 0.000003659 0.55722 26.9841
191 4XV1 904 0.0003432 0.48755 27.0548
192 2B9H ADP 0.000001265 0.57517 27.1955
193 2B9J ADP 0.0000009907 0.57369 27.1955
194 2B9F ADP 0.000001249 0.57241 27.1955
195 2B9I ADP 0.0000007523 0.56613 27.1955
196 3SXS PP2 0.00001214 0.53371 27.2388
197 5UIU 8CG 0.0000004157 0.61982 27.2446
198 3M2W L8I 0.00000007914 0.60047 27.4247
199 3ZRM ZRM 0.000271 0.46827 27.7628
200 5HCY 60D 0.000006212 0.58414 27.7946
201 3HZT J60 0.00001507 0.54237 27.8373
202 4NM5 ADP 0.000001574 0.51404 27.8515
203 5USZ SKE 0.0003981 0.40973 28.0277
204 1CM8 ANP 0.000425 0.45714 28.0654
205 3SXF BK5 0.00000009927 0.47265 28.3058
206 5LPZ ADP 0.0003336 0.45531 28.3133
207 5T8O 76Z 0.00003434 0.47796 28.3668
208 4CQE CQE 0.0005916 0.45962 28.4173
209 2X2M X2M 0.0000009638 0.58613 28.6624
210 5UOX 8GY 0.000001753 0.51501 28.7823
211 3UIM ANP 0.0001297 0.47174 28.8344
212 4AG8 AXI 0.00003134 0.40166 29.1139
213 4NFN 2KC 0.0007758 0.44557 29.1262
214 5EOB 5QQ 0.000002247 0.6174 29.1536
215 4YLL 4E3 0.000000001573 0.71594 29.3629
216 3F7Z 34O 0.00008173 0.49147 29.4286
217 3LXK MI1 0.00000001717 0.67974 29.6636
218 1JPA ANP 0.0001224 0.5263 29.8077
219 5FBN 5WF 0.0000302 0.53925 29.8893
220 5AWM ANP 0.00007087 0.51036 29.9492
221 2XVD AS6 0.0001056 0.4195 30.1325
222 3E8N ATP 0.0000003103 0.41931 30.4985
223 3E8N VRA 0.0000003103 0.41931 30.4985
224 5VCV 1N1 0.00001087 0.47437 30.5466
225 5HX8 66P 0.0000003109 0.50745 30.7947
226 5MJA 7O3 0.000533 0.44749 30.8197
227 4OH4 ANP 0.0001906 0.47508 30.9309
228 4NST ADP 0.00006223 0.4842 31.0541
229 2Y6O 1N1 0.002052 0.4351 31.2715
230 5EFQ ADP 0.0000402 0.50521 31.4121
231 5HVJ ANP 0.000005961 0.5792 31.4286
232 4U44 3D9 0.00003354 0.50871 31.6265
233 1BYG STU 0.0000008808 0.58386 31.6547
234 5LPB ADP 0.0003511 0.44748 31.7568
235 5DBX ANP 0.000001483 0.54939 32.3171
236 5X8I SQZ 0.0000001749 0.59295 32.3699
237 1U5R ATP 0.0000004443 0.57578 32.4713
238 1U59 STU 0.000003517 0.53808 33.101
239 4KS7 X4Z 0.000001415 0.51424 33.2192
240 3KRR DQX 0.0000004189 0.66323 33.2203
241 5JGA 6KC 0.000002211 0.44621 33.3333
242 3C0G 3AM 0.000001504 0.58143 33.6182
243 2HK5 1BM 0.0001546 0.48386 33.7037
244 5JFS 6K0 0.0002367 0.50332 33.7662
245 3NW7 LGV 0.000002462 0.60657 33.8762
246 4Y85 499 0.0004488 0.45609 34.3373
247 4CLI 5P8 0.000003914 0.59394 34.5566
248 4X7Q 3YR 0.000004725 0.53198 34.6154
249 5TA6 79D 0.00003569 0.43492 34.6369
250 1K3A ACP 0.00001468 0.53548 34.7826
251 4EUU BX7 0.00000037 0.50216 34.7962
252 2A19 ANP 0.00001772 0.53901 34.8592
253 3DLS ADP 0.00003419 0.49898 34.9254
254 4JDI ANP 0.0000001024 0.62729 34.9711
255 4Y8D 49J 0.0000528 0.48735 35
256 5DRB 5FJ 0.000001016 0.40763 35.3952
257 1V0O INR 0.00000617 0.51725 35.4167
258 4RT1 C2E 0.0009962 0.44076 35.7143
259 3HMO STU 0.000009022 0.53122 36.5497
260 2ZV2 609 0.000001819 0.58607 36.5772
261 3SRV S19 0.000006334 0.53802 37.1841
262 3FHR P4O 0.000004048 0.52321 37.5
263 2WEI VGG 0.00002053 0.52188 37.6307
264 4F4P 0SB 0.0001228 0.53439 37.7289
265 3PLS ANP 0.000003758 0.54806 37.9195
266 3DAK ANP 0.0000008497 0.56708 37.931
267 2V7O DRN 0.000005012 0.50876 38.0952
268 4G31 0WH 0.0000389 0.40301 38.1271
269 2WEL K88 0.00001141 0.46855 38.2263
270 2YAB AMP 0.00000002317 0.6151 38.2271
271 5VC5 96M 0.00004549 0.52055 38.4083
272 3G5D 1N1 0.00001331 0.57989 38.4615
273 5IH9 6BF 0.000001715 0.60035 38.5075
274 3V8S 0HD 0.00000000238 0.68967 39.0244
275 2F57 23D 0.000006963 0.54316 39.1167
276 5H2U 1N1 0.004318 0.40695 39.3258
277 5DH3 5BS 0.00002374 0.48223 39.3651
278 4BFM ANP 0.00000002133 0.6047 39.521
279 5DA3 58V 0.0000395 0.52244 39.6226
280 5N87 N66 0.00000001139 0.70441 39.9361
281 2VZ6 FEF 0.0000004512 0.60569 39.9361
282 2WQN ADP 0.00001095 0.54139 40
283 3ALN ANP 0.000008471 0.54077 40.367
284 2X4Z X4Z 0.00000006375 0.47909 40.5405
285 3EKK GS2 0.000008437 0.41893 40.7166
286 3BU5 ATP 0.000001028 0.57617 40.8497
287 1ZY5 ANP 0.00000182 0.562 40.9241
288 4QMN DB8 0.000002187 0.43454 40.9677
289 4USF 6UI 0.004299 0.42395 41.1184
290 5TO8 7FM 0.00003158 0.54429 41.1348
291 3GGF GVD 0.000001927 0.55212 41.196
292 5AX9 4KT 0.000127 0.48294 41.2338
293 4CFU 2WC 0.00008931 0.49294 41.2541
294 1UNH IXM 0.00005752 0.50795 41.4384
295 3O0G 3O0 0.0002946 0.46419 41.4384
296 2VN9 GVD 0.000000279 0.55326 41.5282
297 4BCM T7Z 0.00008375 0.44551 41.5282
298 4BCQ TJF 0.0009298 0.42884 41.5282
299 4BCN T9N 0.0004941 0.46458 41.6667
300 4I6H 1C8 0.0003126 0.46551 41.8831
301 4AU8 Z3R 0.0001702 0.45625 41.8919
302 2XMY CDK 0.000004006 0.61441 41.9463
303 3CY2 MB9 0.0001231 0.44613 42.0382
304 5LMK 6ZK 0.0008217 0.43979 42.0875
305 4N70 2HX 0.00003399 0.55295 42.378
306 4YZN 4K5 0.0000002795 0.61331 42.5087
307 1PHK ATP 0.00000002368 0.65266 42.953
308 3SLS ANP 0.0000009402 0.58662 43.0921
309 5HQ0 LZ9 0.000003607 0.5575 43.3775
310 3KN5 ANP 0.000004159 0.52848 43.3846
311 4DC2 ADE 0.0000007554 0.49332 43.4343
312 5G1X ADP 0.000000009108 0.66386 43.5088
313 5L8L ADP 0.000000247 0.62735 43.5088
314 4WNP 3RJ 0.00001694 0.53259 43.554
315 2R5T ANP 0.0000002209 0.55059 43.6997
316 5LXM ADP 0.0000001567 0.60915 43.8163
317 2XK9 XK9 0.0002877 0.52735 44.0994
318 4WB7 ATP 0.0000002735 0.45457 44.1975
319 5JZJ AN2 0.00000000397 0.67983 44.4444
320 4C2V YJA 0.000001894 0.46293 45.2632
321 5EW9 5VC 0.0000002646 0.70105 45.3875
322 4WB6 ATP 0.000000006354 0.69709 45.4286
323 1RE8 BD2 0.00000001676 0.71298 45.7143
324 2QCS ANP 0.000000006513 0.6966 45.7143
325 3IDB ANP 0.0000005188 0.52776 45.7143
326 3E5A VX6 0.0000103 0.46878 45.8955
327 3FHI ANP 0.000000006223 0.69752 46
328 4C2W ANP 0.0000002537 0.56829 46.2366
329 3AQV TAK 0.0005237 0.45551 46.3768
330 3TXO 07U 0.000003313 0.54257 46.7422
331 3TKI S25 0.000000171 0.67197 46.7492
332 2HY0 306 0.0000143 0.53601 46.8944
333 2YAK OSV 0.00000001522 0.52421 47.0175
334 4FG8 ATP 0.000000001622 0.70851 47.3016
335 5EYK 5U5 0.000004478 0.56737 47.4638
336 2GU8 796 0.000000007306 0.74314 47.7745
337 4NW6 2NS 0.0000004783 0.47104 48.2972
338 5LVP ATP 0.00000006878 0.60344 48.5531
339 5LI1 ANP 0.00000003266 0.65283 48.5876
340 2Z7R STU 0.0000002504 0.61269 48.5981
341 4OTH DRN 0.00000003473 0.58147 48.6804
342 5A6N U7E 0.00000122 0.57586 48.7633
343 3MVH WFE 0.000000001887 0.72972 48.8304
344 5LI9 ACP 0.0000002831 0.57106 49.1429
345 1XJD STU 0.000004454 0.52208 49.8551
Pocket No.: 2; Query (leader) PDB : 4L9I; Ligand: 8PR; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 4l9i.bio1) has 18 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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