Receptor
PDB id Resolution Class Description Source Keywords
4LRJ 1.62 Å EC: 2.7.11.1 BACTERIAL EFFECTOR NLEH1 KINASE DOMAIN WITH AMPPNP AND MG2+ ESCHERICHIA COLI STRUCTURAL GENOMICS MONTREAL-KINGSTON BACTERIAL STRUCTURAL INITIATIVE BSGI KINASE FOLD BATERIAL EFFECTOR KINASE TR
Ref.: NLEH DEFINES A NEW FAMILY OF BACTERIAL EFFECTOR KIN STRUCTURE V. 22 250 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:303;
A:302;
B:302;
A:304;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
ANP A:301;
B:301;
Valid;
Valid;
none;
none;
submit data
506.196 C10 H17 N6 O12 P3 c1nc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4LRJ 1.62 Å EC: 2.7.11.1 BACTERIAL EFFECTOR NLEH1 KINASE DOMAIN WITH AMPPNP AND MG2+ ESCHERICHIA COLI STRUCTURAL GENOMICS MONTREAL-KINGSTON BACTERIAL STRUCTURAL INITIATIVE BSGI KINASE FOLD BATERIAL EFFECTOR KINASE TR
Ref.: NLEH DEFINES A NEW FAMILY OF BACTERIAL EFFECTOR KIN STRUCTURE V. 22 250 2014
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 107 families.
1 4LRJ - ANP C10 H17 N6 O12 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 82 families.
1 4LRJ - ANP C10 H17 N6 O12 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 55 families.
1 4LRJ - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ANP; Similar ligands found: 358
No: Ligand ECFP6 Tc MDL keys Tc
1 ANP 1 1
2 A2D 0.810811 0.945205
3 B4P 0.802632 0.945205
4 ADP 0.802632 0.972222
5 AP5 0.802632 0.945205
6 BA3 0.789474 0.945205
7 AU1 0.782051 1
8 ATP 0.772152 0.972222
9 AN2 0.769231 0.986111
10 AQP 0.7625 0.972222
11 5FA 0.7625 0.972222
12 M33 0.759494 0.932432
13 MAP 0.752941 0.972973
14 ACP 0.75 0.945946
15 APR 0.740741 0.945205
16 AR6 0.740741 0.945205
17 ACQ 0.73494 0.945946
18 AD9 0.731707 0.945946
19 SAP 0.731707 0.921053
20 AGS 0.731707 0.921053
21 AMP 0.723684 0.944444
22 A 0.723684 0.944444
23 ATF 0.717647 0.933333
24 ADX 0.716049 0.851852
25 CA0 0.716049 0.92
26 50T 0.707317 0.932432
27 PRX 0.698795 0.87013
28 ABM 0.696203 0.893333
29 AMP MG 0.683544 0.868421
30 AP2 0.679012 0.933333
31 A12 0.679012 0.933333
32 APC 0.678571 0.933333
33 TAT 0.674419 0.933333
34 A22 0.674157 0.958904
35 SRA 0.670886 0.894737
36 SRP 0.670455 0.883117
37 5AL 0.666667 0.906667
38 ADQ 0.659341 0.92
39 A1R 0.659341 0.884615
40 ADP MG 0.654762 0.881579
41 3OD 0.648936 0.92
42 BIS 0.648936 0.909091
43 5SV 0.648352 0.82716
44 BEF ADP 0.647059 0.858974
45 ADP BEF 0.647059 0.858974
46 OAD 0.645161 0.92
47 25L 0.642105 0.958904
48 AMO 0.641304 0.907895
49 G5P 0.636364 0.897436
50 DLL 0.634409 0.906667
51 AHX 0.634409 0.897436
52 00A 0.634409 0.860759
53 ANP MG 0.633333 0.921053
54 ADV 0.632184 0.907895
55 ADP PO3 0.632184 0.917808
56 RBY 0.632184 0.907895
57 NB8 0.631579 0.897436
58 25A 0.630435 0.945205
59 8QN 0.630435 0.906667
60 OOB 0.630435 0.906667
61 G3A 0.626263 0.897436
62 ATP MG 0.625 0.881579
63 4AD 0.623656 0.896104
64 PAJ 0.623656 0.8625
65 LAD 0.621053 0.839506
66 1ZZ 0.614583 0.819277
67 TXA 0.614583 0.907895
68 ME8 0.614583 0.819277
69 GTA 0.613861 0.864198
70 3UK 0.610526 0.894737
71 SON 0.604651 0.907895
72 ADP ALF 0.604396 0.848101
73 ALF ADP 0.604396 0.848101
74 WAQ 0.604167 0.860759
75 PR8 0.604167 0.829268
76 4UV 0.6 0.871795
77 GAP 0.6 0.87013
78 FYA 0.597938 0.881579
79 PTJ 0.597938 0.873418
80 ADP VO4 0.597826 0.906667
81 VO4 ADP 0.597826 0.906667
82 UP5 0.596154 0.896104
83 YAP 0.59596 0.871795
84 FA5 0.59596 0.883117
85 PAP 0.595506 0.958333
86 A4P 0.59434 0.823529
87 XAH 0.59 0.841463
88 4UU 0.588235 0.871795
89 AFH 0.588235 0.8625
90 9SN 0.585859 0.85
91 2A5 0.58427 0.894737
92 T5A 0.583333 0.821429
93 NAI 0.580952 0.884615
94 ITT 0.579545 0.917808
95 ATR 0.577778 0.944444
96 OMR 0.575472 0.831325
97 5AS 0.574713 0.781609
98 YLP 0.571429 0.8
99 48N 0.571429 0.873418
100 AP0 0.570093 0.873418
101 4TC 0.570093 0.873418
102 7D3 0.569767 0.881579
103 ADJ 0.568807 0.831325
104 GNP 0.568421 0.922078
105 DAL AMP 0.568421 0.881579
106 NXX 0.566038 0.907895
107 TXD 0.566038 0.884615
108 NAX 0.566038 0.851852
109 4UW 0.566038 0.839506
110 6V0 0.566038 0.873418
111 DND 0.566038 0.907895
112 XYA 0.565789 0.821918
113 ADN 0.565789 0.821918
114 RAB 0.565789 0.821918
115 AOC 0.564706 0.8
116 7D4 0.561798 0.881579
117 ADP BMA 0.561224 0.894737
118 TXE 0.560748 0.884615
119 TYM 0.560748 0.883117
120 YLB 0.555556 0.8
121 YLC 0.555556 0.819277
122 139 0.554545 0.851852
123 5N5 0.551282 0.797297
124 JB6 0.55 0.860759
125 LAQ 0.54717 0.819277
126 MYR AMP 0.544554 0.797619
127 A4D 0.544304 0.797297
128 5CD 0.544304 0.783784
129 7MD 0.542857 0.864198
130 6AD 0.542553 0.886076
131 A2R 0.541667 0.958904
132 UPA 0.541284 0.884615
133 YLA 0.540541 0.8
134 A A 0.54 0.918919
135 COD 0.539823 0.793103
136 BTX 0.539823 0.821429
137 G5A 0.537634 0.781609
138 CNA 0.535714 0.907895
139 AYB 0.535714 0.790698
140 3DH 0.535714 0.753247
141 BT5 0.535088 0.811765
142 ATP A A A 0.533981 0.905405
143 IOT 0.531532 0.811765
144 MTA 0.53012 0.753247
145 3AM 0.529412 0.90411
146 A3P 0.52809 0.944444
147 NAD 0.526316 0.906667
148 PPS 0.526316 0.851852
149 EP4 0.52439 0.734177
150 7D5 0.52381 0.855263
151 AMP DBH 0.52381 0.87013
152 J7C 0.522727 0.75
153 A5A 0.520833 0.809524
154 EAD 0.520661 0.851852
155 TSB 0.520408 0.821429
156 AHZ 0.518519 0.797619
157 M2T 0.518072 0.716049
158 DTA 0.518072 0.766234
159 A3D 0.517241 0.894737
160 6RE 0.517241 0.740741
161 YLY 0.516949 0.790698
162 SSA 0.515464 0.802326
163 NA7 0.514852 0.933333
164 TYR AMP 0.514286 0.858974
165 AR6 AR6 0.514019 0.893333
166 7MC 0.513514 0.843373
167 A2P 0.511111 0.930556
168 52H 0.510204 0.781609
169 VMS 0.510204 0.790698
170 54H 0.510204 0.790698
171 TAD 0.509259 0.8625
172 NAQ 0.508333 0.85
173 A3N 0.505618 0.766234
174 AV2 0.505155 0.893333
175 5CA 0.50505 0.802326
176 53H 0.50505 0.781609
177 ARU 0.504951 0.839506
178 ARG AMP 0.504587 0.809524
179 ZID 0.504132 0.894737
180 P1H 0.504 0.831325
181 3AT 0.5 0.945205
182 NAE 0.5 0.871795
183 AVV 0.5 0.873418
184 P5A 0.495146 0.747253
185 DSZ 0.49505 0.802326
186 LSS 0.49505 0.764045
187 NSS 0.49505 0.802326
188 N0B 0.491803 0.8
189 AF3 ADP 3PG 0.491071 0.817073
190 LA8 ALF 3PG 0.491071 0.817073
191 ALF ADP 3PG 0.491071 0.817073
192 NVA LMS 0.490196 0.764045
193 DAT 0.489362 0.881579
194 IMO 0.488889 0.90411
195 ZAS 0.488636 0.792208
196 FDA 0.488372 0.813953
197 NAJ PZO 0.487395 0.85
198 4TA 0.487179 0.788235
199 LPA AMP 0.486486 0.797619
200 LEU LMS 0.485437 0.764045
201 DTP 0.484536 0.881579
202 V3L 0.484536 0.945205
203 GJV 0.483516 0.731707
204 S4M 0.483516 0.651685
205 DZD 0.483051 0.8625
206 2AM 0.482759 0.917808
207 5AD 0.481013 0.726027
208 KAA 0.480769 0.755556
209 GSU 0.480769 0.781609
210 NDE 0.480315 0.907895
211 M24 0.479339 0.851852
212 MAO 0.478261 0.761905
213 DSH 0.477778 0.707317
214 NEC 0.477778 0.727273
215 FAD 0.477273 0.831325
216 FAS 0.477273 0.831325
217 RGT 0.476636 0.933333
218 0WD 0.474576 0.897436
219 G A A A 0.474576 0.85
220 FNK 0.474074 0.786517
221 5X8 0.473684 0.74359
222 6FA 0.473282 0.821429
223 FB0 0.472868 0.786517
224 NDC 0.472868 0.85
225 YSA 0.472222 0.781609
226 7DD 0.468085 0.958333
227 OVE 0.466667 0.881579
228 NAD IBO 0.466102 0.848101
229 MHZ 0.463158 0.701149
230 A3G 0.461538 0.779221
231 6C6 0.459184 0.858974
232 U A G G 0.458333 0.860759
233 SFG 0.458333 0.730769
234 7D7 0.45679 0.723684
235 128 0.45614 0.8
236 SFD 0.455224 0.736842
237 DDS 0.454545 0.855263
238 GDP 0.454545 0.896104
239 6IA 0.454545 0.817073
240 NJP 0.453782 0.921053
241 ODP 0.453782 0.886076
242 7DT 0.453608 0.958333
243 A7D 0.452632 0.75641
244 Z5A 0.452381 0.802326
245 WSA 0.452174 0.790698
246 7C5 0.45045 0.797468
247 FAY 0.449275 0.841463
248 NDP 0.449153 0.897436
249 A5D 0.44898 0.766234
250 SA8 0.44898 0.690476
251 NAJ PYZ 0.448 0.851852
252 71V 0.446809 0.884615
253 GGZ 0.446602 0.804878
254 RFL 0.446043 0.802326
255 2SA 0.445545 0.907895
256 AMP NAD 0.444444 0.858974
257 GP3 0.444444 0.897436
258 SAI 0.444444 0.716049
259 SAH 0.444444 0.725
260 A A A 0.443396 0.881579
261 PO4 PO4 A A A A PO4 0.443396 0.878378
262 4YB 0.442478 0.764045
263 GTP 0.441176 0.896104
264 SMM 0.441176 0.670455
265 S7M 0.441176 0.674419
266 Y3J 0.440476 0.706667
267 SAM 0.44 0.674419
268 649 0.439655 0.747253
269 12D 0.438596 0.809524
270 A3S 0.4375 0.789474
271 NPW 0.436975 0.864198
272 GCP 0.436893 0.873418
273 AAT 0.435644 0.690476
274 EEM 0.435644 0.674419
275 GNH 0.435644 0.909091
276 DCA 0.435484 0.804598
277 ETB 0.435484 0.813953
278 N6P 0.433962 0.890411
279 TXP 0.433333 0.897436
280 NZQ 0.433333 0.886076
281 PGS 0.43299 0.860759
282 APU 0.432203 0.871795
283 PUA 0.432 0.8625
284 62F 0.431655 0.841463
285 F2N 0.431507 0.795455
286 DA 0.430108 0.855263
287 D5M 0.430108 0.855263
288 J7V 0.429688 0.813953
289 NIA 0.428571 0.848101
290 6K6 0.428571 0.905405
291 A3T 0.428571 0.8
292 0T1 0.428571 0.804598
293 COA 0.428571 0.804598
294 P5F 0.427586 0.804598
295 AAM 0.425532 0.944444
296 0UM 0.424528 0.682353
297 G1R 0.423077 0.884615
298 AMZ 0.422222 0.891892
299 C2R 0.422222 0.88
300 A U 0.420168 0.848101
301 IDP 0.42 0.894737
302 GSP 0.419048 0.851852
303 COS 0.418605 0.786517
304 CAO 0.418605 0.777778
305 AMX 0.418605 0.813953
306 30N 0.418605 0.736842
307 DG1 0.418605 0.897436
308 1DG 0.418605 0.897436
309 TM1 0.418182 0.797619
310 A6D 0.416667 0.746988
311 K15 0.416667 0.666667
312 V1N 0.415929 0.893333
313 SCO 0.415385 0.804598
314 CMX 0.415385 0.804598
315 GEK 0.415094 0.719512
316 NHD 0.414634 0.881579
317 XNP 0.414634 0.851852
318 AIR 0.413793 0.876712
319 COK 0.413534 0.786517
320 G2R 0.412844 0.8625
321 FCX 0.412214 0.777778
322 FAM 0.412214 0.786517
323 ACO 0.412214 0.777778
324 NAP 0.410853 0.92
325 CNV FAD 0.409722 0.775281
326 FA9 0.409396 0.843373
327 SXZ 0.409091 0.694118
328 HAX 0.409091 0.806818
329 PLP AAD 0.408 0.744444
330 TAP 0.407692 0.884615
331 2MC 0.407407 0.752688
332 62X 0.407407 0.651685
333 GKE 0.40708 0.8625
334 GDD 0.40708 0.8625
335 GDC 0.40708 0.8625
336 FYN 0.406015 0.804598
337 3KK 0.406015 0.786517
338 U G A 0.405797 0.819277
339 NA0 0.40458 0.907895
340 101 0.404255 0.855263
341 G 0.40404 0.883117
342 5GP 0.40404 0.883117
343 MGP 0.403846 0.8625
344 MCD 0.402985 0.786517
345 OXK 0.402985 0.786517
346 CA6 0.402985 0.714286
347 SOP 0.402985 0.786517
348 3AD 0.402299 0.783784
349 S8M 0.401869 0.78481
350 YE1 0.40146 0.795455
351 1VU 0.4 0.777778
352 2VA 0.4 0.779221
353 CMC 0.4 0.786517
354 7RP 0.4 0.902778
355 GMV 0.4 0.873418
356 6G0 0.4 0.8625
357 CO6 0.4 0.786517
358 NMX 0.4 0.782609
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4LRJ; Ligand: ANP; Similar sites found: 291
This union binding pocket(no: 1) in the query (biounit: 4lrj.bio2) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2VZ6 FEF 0.000001391 0.583 None
2 4IDT T28 0.000001619 0.56425 None
3 2OFV 242 0.004249 0.4381 None
4 1RGE 2GP 0.01405 0.41215 None
5 3ZS7 ATP 0.009153 0.40724 None
6 3OCP CMP 0.01145 0.40513 None
7 3H9R TAK 0.0006781 0.42348 1.18343
8 5F90 GLA GAL 0.0136 0.41367 1.28205
9 5F90 LMR 0.01667 0.40778 1.28205
10 4K33 ACP 0.0000001998 0.61111 1.77515
11 3TII ANP 0.001795 0.41409 1.77515
12 3I0O ADP 0.007667 0.41346 1.77515
13 1N07 FMN 0.01715 0.40677 1.84049
14 1IA9 ANP 0.00002353 0.49406 2.36686
15 5FBN 5WF 0.0003029 0.49156 2.36686
16 1W2D ADP 0.0002378 0.48534 2.36686
17 1Y57 MPZ 0.0003033 0.47483 2.36686
18 3G5D 1N1 0.002292 0.4679 2.36686
19 5HX8 66P 0.00001905 0.45311 2.36686
20 4Y93 746 0.00002895 0.45195 2.36686
21 3VPD ANP 0.001499 0.4413 2.36686
22 3WLV AZA 0.006498 0.42641 2.36686
23 4CC6 L5Y 0.008568 0.41561 2.36686
24 4CS9 AMP 0.008622 0.40816 2.36686
25 3UDZ ADP 0.000000009276 0.67091 2.95858
26 4XMF HSM 0.00005609 0.55061 2.95858
27 5VC5 96M 0.00004672 0.52 2.95858
28 4OCV ANP 0.00004985 0.5036 2.95858
29 4YMJ 4EJ 0.000272 0.49877 2.95858
30 4AXD ANP 0.00000002691 0.4626 2.95858
31 2HK5 1BM 0.002159 0.43219 2.95858
32 5W2I ADP 0.0002651 0.41913 2.95858
33 5W2I I3P 0.0002651 0.41913 2.95858
34 2Y6O 1N1 0.001223 0.41104 2.95858
35 3VRY B43 0.0004908 0.40826 2.95858
36 3IX8 TX3 0.0103 0.40802 2.95858
37 1H82 GZZ 0.04934 0.40567 2.95858
38 3CQL NAG 0.02073 0.4028 2.95858
39 2F2U M77 0.00002475 0.53211 3.5503
40 4WNK 453 0.00000001245 0.52855 3.5503
41 5MY8 RXZ 0.0000009491 0.50193 3.5503
42 2QLU ADE 0.000508 0.48957 3.5503
43 5DA3 58V 0.0001973 0.48919 3.5503
44 5FI4 5XV 0.0004743 0.46788 3.5503
45 4QMN DB8 0.000002262 0.43351 3.5503
46 3VSV XYS 0.01022 0.4179 3.5503
47 5A5W GUO 0.01553 0.41617 3.5503
48 5H2U 1N1 0.002886 0.41392 3.5503
49 5XLA SIA 0.01612 0.40996 3.5503
50 3HAV ATP 0.001104 0.4042 3.5503
51 3AB4 THR 0.01663 0.40145 3.5503
52 4H3Q ANP 0.0000002769 0.61349 3.8674
53 4H3P ANP 0.000001716 0.56626 3.8674
54 5EOB 5QQ 0.00001388 0.5779 4.14201
55 3X01 AMP 0.0001143 0.51753 4.14201
56 5CEO 50D 0.00004018 0.50522 4.14201
57 4OAV ACP 0.0001827 0.47338 4.14201
58 4WOV 3SM 0.0005197 0.46356 4.14201
59 4IX4 ADP 0.0004843 0.46149 4.14201
60 3C1X CKK 0.002181 0.43389 4.14201
61 5N87 N66 0.000002173 0.42981 4.14201
62 5D9G GLU ASN LEU TYR PHE GLN 0.01091 0.41045 4.14201
63 5LRT ADP 0.01267 0.40385 4.14201
64 5XLY C2E 0.00305 0.41203 4.51128
65 5MW8 ATP 0.000000007177 0.68586 4.73373
66 3PLS ANP 0.0000005329 0.58562 4.73373
67 2XMY CDK 0.00003707 0.56523 4.73373
68 3NW7 LGV 0.00002893 0.55402 4.73373
69 4FL3 ANP 0.000000526 0.54131 4.73373
70 5IQD RIO 0.00006133 0.52899 4.73373
71 5IQD GNP 0.00005727 0.52899 4.73373
72 4BHN BH9 0.000002999 0.51967 4.73373
73 1K3A ACP 0.00001849 0.50314 4.73373
74 5UOX 8GY 0.000005371 0.5009 4.73373
75 1O9U ADZ 0.00009409 0.49837 4.73373
76 3ZRM ZRM 0.00006339 0.49639 4.73373
77 3F7Z 34O 0.0001535 0.47927 4.73373
78 5DZT AMP 0.001024 0.46844 4.73373
79 4NM5 ADP 0.00003212 0.4655 4.73373
80 5KO1 6UY 0.0003905 0.45877 4.73373
81 3ZJX BOG 0.001797 0.45698 4.73373
82 1UNH IXM 0.0002417 0.45561 4.73373
83 5HES 032 0.0008156 0.45329 4.73373
84 4AU8 Z3R 0.001858 0.44283 4.73373
85 4LH7 1X8 0.004457 0.43796 4.73373
86 3O0G 3O0 0.001249 0.43641 4.73373
87 3DNT ATP 0.002627 0.43377 4.73373
88 2JLD AG1 0.00000765 0.43352 4.73373
89 4R78 AMP 0.006624 0.42109 4.73373
90 5L2J 6UL 0.03539 0.41378 5.10204
91 5L2J 70E 0.03929 0.41257 5.10204
92 2A19 ANP 0.00000142 0.59119 5.32544
93 4ZS4 ATP 0.0000006873 0.55495 5.32544
94 5JKG 6LF 0.00002452 0.54815 5.32544
95 3PDT ADP 0.00001528 0.52769 5.32544
96 4WW7 AMP 0.00002047 0.52592 5.32544
97 5UR1 YY9 0.0001225 0.51969 5.32544
98 5JFS 6K0 0.0005872 0.48422 5.32544
99 1OBD ATP 0.00005804 0.4816 5.32544
100 5MRH Q9Z 0.001007 0.46111 5.32544
101 2VPQ ANP 0.000832 0.45483 5.32544
102 4I6H 1C8 0.0003711 0.45246 5.32544
103 3GC0 AMP 0.0004497 0.44635 5.32544
104 4XYM A12 0.000725 0.43343 5.32544
105 4U0I 0LI 0.005247 0.42875 5.32544
106 5USZ SKE 0.0001171 0.42368 5.32544
107 3GC8 B45 0.0007463 0.42046 5.32544
108 3KYG 5GP 5GP 0.004315 0.41254 5.32544
109 2RDE C2E 0.003068 0.40754 5.32544
110 4EN4 GT0 0.02361 0.40534 5.32544
111 4EN4 ATP 0.02361 0.40534 5.32544
112 4EN4 GT1 0.02361 0.40534 5.32544
113 4XLI 1N1 0.006408 0.40492 5.32544
114 5C1P ADP 0.008088 0.40814 5.55556
115 2C94 TSF 0.02382 0.40104 5.625
116 5K2M ADP 0.0009916 0.45319 5.66038
117 4YLL 4E3 0.00000007796 0.6386 5.91716
118 4XH0 ADP 0.000004547 0.58986 5.91716
119 3WO0 ALA 0.0005284 0.48399 5.91716
120 2H8H H8H 0.0001478 0.48001 5.91716
121 3UIM ANP 0.0002134 0.4729 5.91716
122 3WVR AMP 0.0009133 0.43852 5.91716
123 1IOW PHY 0.01137 0.41646 5.91716
124 5FQK 6NT 0.01542 0.4084 5.91716
125 4L9I 8PR 0.0000005839 0.58386 6.50888
126 5X8I SQZ 0.00000177 0.55106 6.50888
127 3GNI ATP 0.0000009154 0.54057 6.50888
128 3TXO 07U 0.000005766 0.53221 6.50888
129 5LPB ADP 0.0001174 0.49993 6.50888
130 4ASE AV9 0.0003506 0.4793 6.50888
131 1M0W ANP 0.0001746 0.46925 6.50888
132 5LPZ ADP 0.0001847 0.4659 6.50888
133 5TA6 79D 0.000006096 0.45764 6.50888
134 5T8O 76Z 0.0001757 0.44903 6.50888
135 3D91 REM 0.02903 0.44232 6.50888
136 5JGA 6KC 0.000008462 0.42989 6.50888
137 4K39 SAM 0.005395 0.41032 6.50888
138 4RDL FUC GAL NDG FUC 0.01779 0.40755 6.50888
139 4K38 SAM 0.007169 0.40676 6.50888
140 3VHE 42Q 0.0001782 0.40354 6.50888
141 4K37 SAM 0.006989 0.40324 6.50888
142 3G08 FEE 0.02293 0.4176 7.07071
143 5LI1 ANP 0.0000000005588 0.73299 7.10059
144 5LI9 ACP 0.000000006472 0.63674 7.10059
145 3ALN ANP 0.0000005061 0.55009 7.10059
146 2ZV2 609 0.00001432 0.54341 7.10059
147 2X2M X2M 0.00001233 0.5359 7.10059
148 1XJD STU 0.000005525 0.52014 7.10059
149 3BU5 ATP 0.00002701 0.51291 7.10059
150 3LXK MI1 0.0000008537 0.48686 7.10059
151 3KRL KRL 0.0002247 0.4787 7.10059
152 5CKW ANP 0.0002923 0.45085 7.10059
153 4DC2 ADE 0.00002664 0.44659 7.10059
154 2AQX ATP 0.001158 0.44639 7.10059
155 1G51 AMO 0.00925 0.41311 7.10059
156 5IGI GMP 0.01894 0.40798 7.10059
157 5IGI ZIT 0.01989 0.40798 7.10059
158 2R7K AMZ 0.01472 0.40501 7.10059
159 5U98 1KX 0.04603 0.40481 7.10059
160 5N1X 8HH 0.009194 0.40266 7.62712
161 2QCS ANP 0.00000001049 0.68701 7.69231
162 1RE8 BD2 0.000002647 0.60502 7.69231
163 3KRR DQX 0.00002617 0.57201 7.69231
164 4OTH DRN 0.000000136 0.55979 7.69231
165 1U59 STU 0.00001471 0.5113 7.69231
166 4CFU 2WC 0.0004105 0.46292 7.69231
167 5LMK 6ZK 0.0005399 0.44813 7.69231
168 4BCN T9N 0.002041 0.43597 7.69231
169 1VJY 460 0.000009743 0.42859 7.69231
170 3KMW ATP 0.002537 0.42277 7.69231
171 4BCM T7Z 0.00101 0.41098 7.69231
172 3ORQ ADP 0.001874 0.40881 7.69231
173 4BCQ TJF 0.001785 0.40849 7.69231
174 2FB3 GTP 0.01379 0.40764 7.69231
175 3IDB ANP 0.000009216 0.48217 8.07453
176 5UKL SIX 0.00000000887 0.69308 8.28402
177 3TDV GDP 0.00000001826 0.63504 8.28402
178 4YZC STU 0.000003489 0.58726 8.28402
179 2PVF ACP 0.000002692 0.55448 8.28402
180 2VN9 GVD 0.0000005998 0.54146 8.28402
181 3PVW QRX 0.0000001248 0.52486 8.28402
182 4OCJ NDG 0.00008476 0.52223 8.28402
183 4FE2 ADP 0.00004523 0.5128 8.28402
184 4O1P ANP 0.00003711 0.50676 8.28402
185 3RI1 3RH 0.00008574 0.50589 8.28402
186 2PUL ACP 0.00003577 0.50473 8.28402
187 2WEL K88 0.00007012 0.44152 8.28402
188 4FE2 AIR 0.005882 0.41896 8.28402
189 3NOJ PYR 0.01461 0.41511 8.28402
190 4KBA 1QM 0.0003103 0.40019 8.28402
191 3FHI ANP 0.00000001638 0.67805 8.44156
192 5HWV MBN 0.001112 0.40689 8.46154
193 3SRV S19 0.00001941 0.51648 8.87574
194 2WU6 DKI 0.000003616 0.49674 8.87574
195 3SXS PP2 0.00001029 0.49627 8.87574
196 4F4P 0SB 0.004715 0.4545 8.87574
197 1LR8 IHS 0.01021 0.40823 9.45946
198 5GZ9 ANP 0.0000001231 0.62956 9.46746
199 1PHK ATP 0.0000006689 0.58758 9.46746
200 1OUK 084 0.00009422 0.56524 9.46746
201 5HQ0 LZ9 0.00001459 0.49257 9.46746
202 4LOO SB4 0.0001686 0.47746 9.46746
203 2XVD AS6 0.0004546 0.4757 9.46746
204 5EKO N17 0.0003844 0.47014 9.46746
205 4UWH JXM 0.001202 0.44176 9.46746
206 5BYZ 4WE 0.0000711 0.40951 9.46746
207 1T36 ADP 0.01502 0.40325 9.46746
208 5C4L 4XR 0.000005483 0.56918 10.0592
209 5C4L SIS 0.000006879 0.56454 10.0592
210 1BYG STU 0.00000202 0.55218 10.0592
211 4DFU QUE 0.0002137 0.50089 10.0592
212 3E7O 35F 0.0002598 0.49027 10.0592
213 4D2S DYK 0.0001934 0.48349 10.0592
214 1ZY5 ANP 0.0003781 0.45939 10.0592
215 4WB6 ATP 0.000000005648 0.69946 10.6509
216 3LXN MI1 0.0000005382 0.59478 10.6509
217 4GJ3 0XP 0.00000849 0.56024 10.6509
218 2PYW ADP 0.000008045 0.50392 10.6509
219 5I35 ANP 0.00004736 0.49934 10.6509
220 2BKK ADP 0.00138 0.42531 10.6509
221 2QK4 ATP 0.002493 0.40381 10.6509
222 1Y7P RIP 0.005189 0.42403 11.2108
223 2IF8 ADP 0.00006609 0.52648 11.2426
224 2F57 23D 0.00002546 0.5037 11.2426
225 3HMO STU 0.00004383 0.50083 11.2426
226 4CYI ATP 0.0003999 0.46524 11.2426
227 5MJA 7O3 0.001663 0.42551 11.2426
228 5DBX ANP 0.0000001414 0.5895 11.8343
229 2VQD AP2 0.0001941 0.47941 11.8343
230 4WB7 ATP 0.0000001535 0.46096 11.8343
231 1CM8 ANP 0.0005166 0.45339 11.8343
232 4AUA 4AU 0.001045 0.43984 11.8343
233 3ETH ATP 0.003581 0.42411 11.8343
234 2YW2 ATP 0.0016 0.41665 11.8343
235 4U98 ACP 0.003553 0.41628 11.8343
236 4FG8 ATP 0.0000000009016 0.72002 12.426
237 5LXC 7AA 0.0000006144 0.57438 12.426
238 4ANW O92 0.000405 0.48269 12.426
239 4BTK DTQ 0.0001603 0.47844 12.426
240 5VZ0 ADP 0.002176 0.42573 12.426
241 3SXF BK5 0.000003611 0.58318 13.0178
242 3GQI ACP 0.000001677 0.5667 13.0178
243 1U5R ATP 0.000003099 0.55177 13.0178
244 5AWM ANP 0.00001112 0.54864 13.0178
245 4NST ADP 0.00003096 0.51026 13.0178
246 5EFQ ADP 0.00003462 0.49676 13.0178
247 5C03 AGS 0.00004187 0.49221 13.0178
248 1GSA ADP 0.0002685 0.47724 13.0178
249 1ZP9 ATP 0.0001281 0.47534 13.0178
250 1ZTH ADP 0.0001827 0.45529 13.0178
251 1E4E ADP 0.004805 0.41457 13.0178
252 3IGO ANP 0.0000002898 0.54868 13.6095
253 2WEI VGG 0.00018 0.46762 13.6095
254 4CLI 5P8 0.0000282 0.55206 14.2012
255 2GQR ADP 0.00001125 0.52698 14.2012
256 4E1Z 0MX 0.000002144 0.50556 14.2012
257 1V0O INR 0.0000231 0.4934 14.2012
258 3PP0 03Q 0.0001305 0.42107 14.2012
259 2GQS ADP 0.00001386 0.52296 14.7929
260 3VPC ADP 0.0003184 0.43302 14.7929
261 3HZT J60 0.000008918 0.50627 15.9763
262 4EWH T77 0.000004022 0.46795 15.9763
263 5TDF ADP 0.001359 0.44127 16.568
264 4QTB 38Z 0.000001962 0.58616 17.1598
265 2B9F ADP 0.000005552 0.54353 17.1598
266 2B9J ADP 0.000006942 0.53626 17.1598
267 2B9H ADP 0.000009321 0.53626 17.1598
268 2B9I ADP 0.000007863 0.52263 17.1598
269 2V7O DRN 0.000008893 0.49718 17.1598
270 3VOT ADP 0.0008113 0.42848 17.1598
271 4E93 GUI 0.00005706 0.41187 17.1598
272 4UX9 ANP 0.00000007529 0.58261 17.7515
273 4IZY 1J2 0.000000127 0.57287 17.7515
274 4GYI ADP 0.000004794 0.55805 17.7515
275 2HGS ADP 0.00002864 0.52159 18.9349
276 1TQP ATP 0.000005093 0.48671 18.9349
277 4NG2 OHN 0.005843 0.41782 19.0217
278 3TTI KBI 0.0000001403 0.51281 20.7101
279 3PTG 932 0.00006901 0.46181 20.7101
280 3SLS ANP 0.000001024 0.52765 22.4852
281 3E8N ATP 0.0000004445 0.41142 22.4852
282 3E8N VRA 0.0000004445 0.41142 22.4852
283 5U6C 7YS 0.0004055 0.42879 23.0769
284 4OYA 1VE 0.001103 0.49023 23.6686
285 3VPB ADP 0.0003503 0.41858 26.7857
286 4Y85 499 0.0002935 0.46426 27.2189
287 2CSN CKI 0.00000004558 0.65748 29.5858
288 3LQV ADE 0.01193 0.41399 30.4348
289 4AZW ATP 0.00008428 0.49575 32.5444
290 4AZT LY2 0.00006137 0.4774 32.5444
291 4Q5H ANP 0.0000000182 0.63507 39.645
Pocket No.: 2; Query (leader) PDB : 4LRJ; Ligand: ANP; Similar sites found: 38
This union binding pocket(no: 2) in the query (biounit: 4lrj.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2CDO GAL AAL GAL AAL GAL AAL 0.01635 0.41219 1.875
2 5ML3 DL3 0.01625 0.41224 2.68456
3 2QES ADE 0.02334 0.40055 3.5503
4 1DZK PRZ 0.002561 0.42259 3.82166
5 4L6H HCS 0.01279 0.41364 4.14201
6 3K5I ADP 0.002609 0.40522 4.14201
7 1N62 MCN 0.02323 0.40469 4.14201
8 1NJJ GET 0.02151 0.40192 4.14201
9 3ZGJ RMN 0.01678 0.40125 4.14201
10 1TMM APC 0.02146 0.40637 4.43038
11 1TMM HHR 0.02045 0.40637 4.43038
12 5BWD FUM 0.01322 0.41205 5.32544
13 2CFM AMP 0.01227 0.4037 5.32544
14 3L24 GOA 0.008208 0.40287 5.32544
15 3WO0 ADP 0.03861 0.41872 5.91716
16 5DP2 NAP 0.01493 0.40472 5.91716
17 2BKA NDP 0.01571 0.40497 6.50888
18 1UYY BGC BGC 0.014 0.4096 6.87023
19 2CIG 1DG 0.0343 0.40186 6.91824
20 1SN0 T44 0.009927 0.404 6.92308
21 4D42 W0I 0.02223 0.41683 7.10059
22 4D42 NAP 0.02223 0.41683 7.10059
23 1AUX AGS 0.002612 0.41638 7.10059
24 3EKK GS2 0.00001289 0.41113 7.10059
25 2GZ3 NAP 0.02101 0.4173 7.69231
26 3HRD MCN 0.02472 0.40133 8.125
27 3DGY 2GP 0.01586 0.40936 8.24742
28 2XZ9 PYR 0.017 0.40698 8.87574
29 4J1Q NDP 0.008757 0.4156 11.8343
30 2GAG FAD 0.03506 0.40382 14.1414
31 2GAG FOA 0.03506 0.40382 14.1414
32 5W10 CMP 0.006237 0.40948 14.2012
33 2Y88 2ER 0.01445 0.41366 14.7929
34 5EVY SAL 0.008092 0.42466 16.568
35 1EBF NAD 0.01255 0.40405 17.7515
36 4RPL 3UC 0.03954 0.41354 18.9349
37 3KYF 5GP 5GP 0.01051 0.40691 19.5266
38 1YRO UDP 0.02262 0.40509 21.1382
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