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Receptor
PDB id Resolution Class Description Source Keywords
2VPQ 2.1 Å EC: 6.3.4.14 CRYSTAL STRUCTURE OF BIOTIN CARBOXYLASE FROM S. AUREUS COMPLEXED WITH AMPPNP STAPHYLOCOCCUS AUREUS BACTERIA ATP-GRASP DOMAIN BIOTIN CARBOXYLASE LIGASE
Ref.: STRUCTURAL EVIDENCE FOR SUBSTRATE-INDUCED SYNERGISM AND HALF-SITES REACTIVITY IN BIOTIN CARBOXYLASE. PROTEIN SCI. V. 17 1706 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ANP A:1449;
B:1450;
Valid;
Valid;
none;
none;
submit data
506.196 C10 H17 N6 O12 P3 c1nc(...
CL A:1452;
B:1453;
Invalid;
Invalid;
none;
none;
submit data
35.453 Cl [Cl-]
MG A:1450;
A:1451;
B:1451;
B:1452;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2VPQ 2.1 Å EC: 6.3.4.14 CRYSTAL STRUCTURE OF BIOTIN CARBOXYLASE FROM S. AUREUS COMPLEXED WITH AMPPNP STAPHYLOCOCCUS AUREUS BACTERIA ATP-GRASP DOMAIN BIOTIN CARBOXYLASE LIGASE
Ref.: STRUCTURAL EVIDENCE FOR SUBSTRATE-INDUCED SYNERGISM AND HALF-SITES REACTIVITY IN BIOTIN CARBOXYLASE. PROTEIN SCI. V. 17 1706 2008
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 2VPQ - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
70% Homology Family (29)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2W6O ic50 = 60.8 uM OA3 C10 H13 N3 O CC1(Cc2c(c....
2 3JZI ic50 = 5 uM JZL C23 H28 Cl N5 O2 c1ccc(c(c1....
3 3JZF ic50 = 5 uM JZK C22 H25 Cl N4 O c1ccc(c(c1....
4 3G8C - BTN C10 H16 N2 O3 S C1[C@H]2[C....
5 3RV3 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
6 2V59 Kd = 6.53 nM LZK C15 H15 N5 O2 COc1cccc(c....
7 2W70 ic50 = 12 uM L22 C7 H7 N5 S c1cnc(nc1c....
8 3RV4 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
9 2W6P ic50 = 0.333 uM OA4 C15 H14 N4 Cc1c(ccc2c....
10 3G8D - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
11 1DV2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
12 2V5A ic50 = 150 nM LZL C17 H15 N5 c1ccc(cc1)....
13 2W6N ic50 = 0.125 uM OA2 C18 H17 N3 O2 c1ccc(cc1)....
14 2W6M ic50 = 21.5 uM OA1 C10 H7 Br N2 O2 c1cc(cc(c1....
15 2W6Q ic50 = 25.4 uM OA5 C11 H13 N5 O2 c1ccc(cc1)....
16 2J9G - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
17 2W6Z ic50 = 1500 uM L21 C10 H13 N5 CC(=CCn1cn....
18 2V58 Kd = 0.82 nM LZJ C13 H9 Br2 N5 c1cc(c(c(c....
19 3RUP - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
20 2W71 ic50 = 0.334 uM L23 C15 H13 Cl2 N5 Cc1nc(cn1C....
21 2VQD - AP2 C11 H17 N5 O9 P2 c1nc(c2c(n....
22 4MV6 - PCT C2 H6 N O4 P C(C(=O)N)P....
23 4RZQ - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
24 4MV4 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
25 4MV1 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
26 4MV8 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
27 4MV7 - PPF C H3 O5 P C(=O)(O)P(....
28 4MV3 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
29 2VPQ - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
50% Homology Family (29)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2W6O ic50 = 60.8 uM OA3 C10 H13 N3 O CC1(Cc2c(c....
2 3JZI ic50 = 5 uM JZL C23 H28 Cl N5 O2 c1ccc(c(c1....
3 3JZF ic50 = 5 uM JZK C22 H25 Cl N4 O c1ccc(c(c1....
4 3G8C - BTN C10 H16 N2 O3 S C1[C@H]2[C....
5 3RV3 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
6 2V59 Kd = 6.53 nM LZK C15 H15 N5 O2 COc1cccc(c....
7 2W70 ic50 = 12 uM L22 C7 H7 N5 S c1cnc(nc1c....
8 3RV4 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
9 2W6P ic50 = 0.333 uM OA4 C15 H14 N4 Cc1c(ccc2c....
10 3G8D - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
11 1DV2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
12 2V5A ic50 = 150 nM LZL C17 H15 N5 c1ccc(cc1)....
13 2W6N ic50 = 0.125 uM OA2 C18 H17 N3 O2 c1ccc(cc1)....
14 2W6M ic50 = 21.5 uM OA1 C10 H7 Br N2 O2 c1cc(cc(c1....
15 2W6Q ic50 = 25.4 uM OA5 C11 H13 N5 O2 c1ccc(cc1)....
16 2J9G - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
17 2W6Z ic50 = 1500 uM L21 C10 H13 N5 CC(=CCn1cn....
18 2V58 Kd = 0.82 nM LZJ C13 H9 Br2 N5 c1cc(c(c(c....
19 3RUP - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
20 2W71 ic50 = 0.334 uM L23 C15 H13 Cl2 N5 Cc1nc(cn1C....
21 2VQD - AP2 C11 H17 N5 O9 P2 c1nc(c2c(n....
22 4MV6 - PCT C2 H6 N O4 P C(C(=O)N)P....
23 4RZQ - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
24 4MV4 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
25 4MV1 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
26 4MV8 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
27 4MV7 - PPF C H3 O5 P C(=O)(O)P(....
28 4MV3 - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
29 2VPQ - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ANP; Similar ligands found: 373
No: Ligand ECFP6 Tc MDL keys Tc
1 ANP 1 1
2 A2D 0.810811 0.945205
3 B4P 0.802632 0.945205
4 AP5 0.802632 0.945205
5 ADP 0.802632 0.972222
6 BA3 0.789474 0.945205
7 AU1 0.782051 1
8 HEJ 0.772152 0.972222
9 ATP 0.772152 0.972222
10 AT4 0.769231 0.933333
11 AN2 0.769231 0.986111
12 5FA 0.7625 0.972222
13 AQP 0.7625 0.972222
14 M33 0.759494 0.932432
15 MAP 0.752941 0.972973
16 ACP 0.75 0.945946
17 AR6 0.740741 0.945205
18 APR 0.740741 0.945205
19 ACQ 0.73494 0.945946
20 AD9 0.731707 0.945946
21 SAP 0.731707 0.921053
22 AGS 0.731707 0.921053
23 A 0.723684 0.944444
24 AMP 0.723684 0.944444
25 ATF 0.717647 0.933333
26 ADX 0.716049 0.851852
27 CA0 0.716049 0.92
28 6YZ 0.709302 0.945946
29 50T 0.707317 0.932432
30 PRX 0.698795 0.87013
31 ABM 0.696203 0.893333
32 AP2 0.679012 0.933333
33 A12 0.679012 0.933333
34 APC 0.678571 0.933333
35 T99 0.674419 0.933333
36 TAT 0.674419 0.933333
37 A22 0.674157 0.958904
38 SRA 0.670886 0.894737
39 SRP 0.670455 0.883117
40 5AL 0.666667 0.906667
41 A1R 0.659341 0.884615
42 ADQ 0.659341 0.92
43 A3R 0.659341 0.884615
44 3OD 0.648936 0.92
45 BIS 0.648936 0.909091
46 5SV 0.648352 0.82716
47 9X8 0.645161 0.896104
48 OAD 0.645161 0.92
49 25L 0.642105 0.958904
50 AMO 0.641304 0.907895
51 G5P 0.636364 0.897436
52 DLL 0.634409 0.906667
53 AHX 0.634409 0.897436
54 00A 0.634409 0.860759
55 ADV 0.632184 0.907895
56 RBY 0.632184 0.907895
57 ADP PO3 0.632184 0.917808
58 NB8 0.631579 0.897436
59 25A 0.630435 0.945205
60 OOB 0.630435 0.906667
61 8QN 0.630435 0.906667
62 G3A 0.626263 0.897436
63 4AD 0.623656 0.896104
64 PAJ 0.623656 0.8625
65 LAD 0.621053 0.839506
66 TXA 0.614583 0.907895
67 1ZZ 0.614583 0.819277
68 ME8 0.614583 0.819277
69 GTA 0.613861 0.864198
70 9ZD 0.612903 0.909091
71 9ZA 0.612903 0.909091
72 3UK 0.610526 0.894737
73 SON 0.604651 0.907895
74 ADP ALF 0.604396 0.848101
75 ALF ADP 0.604396 0.848101
76 PR8 0.604167 0.829268
77 B5V 0.604167 0.883117
78 WAQ 0.604167 0.860759
79 4UV 0.6 0.871795
80 GAP 0.6 0.87013
81 PTJ 0.597938 0.873418
82 FYA 0.597938 0.881579
83 VO4 ADP 0.597826 0.906667
84 ADP VO4 0.597826 0.906667
85 LMS 0.597561 0.829268
86 UP5 0.596154 0.896104
87 FA5 0.59596 0.883117
88 YAP 0.59596 0.871795
89 PAP 0.595506 0.958333
90 A4P 0.59434 0.823529
91 XAH 0.59 0.841463
92 4UU 0.588235 0.871795
93 AFH 0.588235 0.8625
94 9SN 0.585859 0.85
95 2A5 0.58427 0.894737
96 T5A 0.583333 0.821429
97 DQV 0.582524 0.932432
98 NAI 0.580952 0.884615
99 B5M 0.58 0.871795
100 B5Y 0.58 0.871795
101 ITT 0.579545 0.917808
102 ATR 0.577778 0.944444
103 OMR 0.575472 0.831325
104 5AS 0.574713 0.781609
105 YLP 0.571429 0.8
106 48N 0.571429 0.873418
107 AP0 0.570093 0.873418
108 4TC 0.570093 0.873418
109 7D3 0.569767 0.881579
110 ADJ 0.568807 0.831325
111 GNP 0.568421 0.922078
112 9GM 0.568421 0.922078
113 DAL AMP 0.568421 0.881579
114 6V0 0.566038 0.873418
115 TXD 0.566038 0.884615
116 DND 0.566038 0.907895
117 NAX 0.566038 0.851852
118 4UW 0.566038 0.839506
119 NXX 0.566038 0.907895
120 XYA 0.565789 0.821918
121 RAB 0.565789 0.821918
122 ADN 0.565789 0.821918
123 AOC 0.564706 0.8
124 7D4 0.561798 0.881579
125 ADP BMA 0.561224 0.894737
126 TXE 0.560748 0.884615
127 TYM 0.560748 0.883117
128 GA7 0.557692 0.883117
129 YLC 0.555556 0.819277
130 YLB 0.555556 0.8
131 139 0.554545 0.851852
132 5N5 0.551282 0.797297
133 JB6 0.55 0.860759
134 LAQ 0.54717 0.819277
135 F2R 0.544643 0.843373
136 MYR AMP 0.544554 0.797619
137 5CD 0.544304 0.783784
138 A4D 0.544304 0.797297
139 80F 0.54386 0.821429
140 7MD 0.542857 0.864198
141 6AD 0.542553 0.886076
142 A2R 0.541667 0.958904
143 UPA 0.541284 0.884615
144 YLA 0.540541 0.8
145 A A 0.54 0.918919
146 BTX 0.539823 0.821429
147 COD 0.539823 0.793103
148 HFD 0.537634 0.921053
149 G5A 0.537634 0.781609
150 3DH 0.535714 0.753247
151 AYB 0.535714 0.790698
152 CNA 0.535714 0.907895
153 BT5 0.535088 0.811765
154 ATP A A A 0.533981 0.905405
155 IOT 0.531532 0.811765
156 MTA 0.53012 0.753247
157 3AM 0.529412 0.90411
158 A3P 0.52809 0.944444
159 PPS 0.526316 0.851852
160 NAD 0.526316 0.906667
161 EP4 0.52439 0.734177
162 7D5 0.52381 0.855263
163 AMP DBH 0.52381 0.87013
164 J7C 0.522727 0.75
165 A5A 0.520833 0.809524
166 EAD 0.520661 0.851852
167 TSB 0.520408 0.821429
168 AHZ 0.518519 0.797619
169 DTA 0.518072 0.766234
170 M2T 0.518072 0.716049
171 A3D 0.517241 0.894737
172 6RE 0.517241 0.740741
173 YLY 0.516949 0.790698
174 SSA 0.515464 0.802326
175 NA7 0.514852 0.933333
176 ARG AMP 0.514019 0.809524
177 AR6 AR6 0.514019 0.893333
178 7MC 0.513514 0.843373
179 A2P 0.511111 0.930556
180 52H 0.510204 0.781609
181 VMS 0.510204 0.790698
182 54H 0.510204 0.790698
183 TYR AMP 0.509434 0.848101
184 TAD 0.509259 0.8625
185 NAQ 0.508333 0.85
186 A3N 0.505618 0.766234
187 AV2 0.505155 0.893333
188 53H 0.50505 0.781609
189 5CA 0.50505 0.802326
190 8X1 0.50505 0.755556
191 ARU 0.504951 0.839506
192 ZID 0.504132 0.894737
193 P1H 0.504 0.831325
194 NAE 0.5 0.871795
195 3AT 0.5 0.945205
196 AVV 0.5 0.873418
197 P5A 0.495146 0.747253
198 NSS 0.49505 0.802326
199 LSS 0.49505 0.764045
200 DSZ 0.49505 0.802326
201 N0B 0.491803 0.8
202 AF3 ADP 3PG 0.491071 0.817073
203 NVA LMS 0.490196 0.755556
204 DAT 0.489362 0.881579
205 IMO 0.488889 0.90411
206 ZAS 0.488636 0.792208
207 FDA 0.488372 0.813953
208 NAJ PZO 0.487395 0.85
209 4TA 0.487179 0.788235
210 LPA AMP 0.486486 0.797619
211 LEU LMS 0.485437 0.755556
212 DTP 0.484536 0.881579
213 V3L 0.484536 0.945205
214 S4M 0.483516 0.651685
215 GJV 0.483516 0.731707
216 DZD 0.483051 0.8625
217 2AM 0.482759 0.917808
218 5AD 0.481013 0.726027
219 GSU 0.480769 0.781609
220 KAA 0.480769 0.755556
221 NDE 0.480315 0.907895
222 M24 0.479339 0.851852
223 MAO 0.478261 0.761905
224 NEC 0.477778 0.727273
225 DSH 0.477778 0.707317
226 FAS 0.477273 0.831325
227 FAD 0.477273 0.831325
228 RGT 0.476636 0.933333
229 9K8 0.47619 0.698925
230 G A A A 0.474576 0.85
231 0WD 0.474576 0.897436
232 FNK 0.474074 0.786517
233 5X8 0.473684 0.74359
234 6FA 0.473282 0.821429
235 NDC 0.472868 0.85
236 FB0 0.472868 0.786517
237 YSA 0.472222 0.781609
238 7DD 0.468085 0.958333
239 OVE 0.466667 0.881579
240 MHZ 0.463158 0.701149
241 8PZ 0.462963 0.802326
242 A G 0.462185 0.860759
243 AMP NAD 0.462185 0.881579
244 A3G 0.461538 0.779221
245 NAJ PYZ 0.459677 0.809524
246 6C6 0.459184 0.858974
247 SFG 0.458333 0.730769
248 U A G G 0.458333 0.860759
249 7D7 0.45679 0.723684
250 128 0.45614 0.8
251 SFD 0.455224 0.736842
252 6IA 0.454545 0.817073
253 DDS 0.454545 0.855263
254 GDP 0.454545 0.896104
255 ODP 0.453782 0.886076
256 NJP 0.453782 0.921053
257 7DT 0.453608 0.958333
258 A7D 0.452632 0.75641
259 Z5A 0.452381 0.802326
260 WSA 0.452174 0.790698
261 U A 0.45082 0.884615
262 7C5 0.45045 0.797468
263 FAY 0.449275 0.841463
264 NDP 0.449153 0.897436
265 SA8 0.44898 0.690476
266 A5D 0.44898 0.766234
267 71V 0.446809 0.884615
268 GGZ 0.446602 0.804878
269 RFL 0.446043 0.802326
270 2SA 0.445545 0.907895
271 SAI 0.444444 0.716049
272 GP3 0.444444 0.897436
273 SAH 0.444444 0.725
274 PO4 PO4 A A A A PO4 0.443396 0.878378
275 A A A 0.443396 0.881579
276 4YB 0.442478 0.764045
277 SMM 0.441176 0.670455
278 S7M 0.441176 0.674419
279 GTP 0.441176 0.896104
280 Y3J 0.440476 0.706667
281 SAM 0.44 0.674419
282 649 0.439655 0.747253
283 12D 0.438596 0.809524
284 A3S 0.4375 0.789474
285 NPW 0.436975 0.864198
286 GCP 0.436893 0.873418
287 AAT 0.435644 0.690476
288 GNH 0.435644 0.909091
289 EEM 0.435644 0.674419
290 ETB 0.435484 0.813953
291 DCA 0.435484 0.804598
292 N6P 0.433962 0.890411
293 NZQ 0.433333 0.886076
294 TXP 0.433333 0.897436
295 PGS 0.43299 0.860759
296 APU 0.432203 0.871795
297 PUA 0.432 0.8625
298 62F 0.431655 0.841463
299 F2N 0.431507 0.795455
300 DA 0.430108 0.855263
301 D5M 0.430108 0.855263
302 J7V 0.429688 0.813953
303 NIA 0.428571 0.848101
304 COA 0.428571 0.804598
305 6K6 0.428571 0.905405
306 A3T 0.428571 0.8
307 0T1 0.428571 0.804598
308 P5F 0.427586 0.804598
309 AAM 0.425532 0.944444
310 0UM 0.424528 0.682353
311 8Q2 0.423729 0.775281
312 G1R 0.423077 0.884615
313 AMZ 0.422222 0.891892
314 C2R 0.422222 0.88
315 A U 0.420168 0.848101
316 IDP 0.42 0.894737
317 GSP 0.419048 0.851852
318 30N 0.418605 0.736842
319 CAO 0.418605 0.777778
320 DG1 0.418605 0.897436
321 1DG 0.418605 0.897436
322 COS 0.418605 0.786517
323 AMX 0.418605 0.813953
324 TM1 0.418182 0.797619
325 A6D 0.416667 0.746988
326 K15 0.416667 0.666667
327 V1N 0.415929 0.893333
328 CMX 0.415385 0.804598
329 SCO 0.415385 0.804598
330 GEK 0.415094 0.719512
331 XNP 0.414634 0.851852
332 NHD 0.414634 0.881579
333 9JJ 0.413793 0.841463
334 AIR 0.413793 0.876712
335 COK 0.413534 0.786517
336 G2R 0.412844 0.8625
337 ACO 0.412214 0.777778
338 FAM 0.412214 0.786517
339 FCX 0.412214 0.777778
340 NAP 0.410853 0.92
341 FA9 0.409396 0.843373
342 SXZ 0.409091 0.694118
343 HAX 0.409091 0.806818
344 TAP 0.407692 0.884615
345 2MC 0.407407 0.752688
346 62X 0.407407 0.651685
347 GKE 0.40708 0.8625
348 GDC 0.40708 0.8625
349 GDD 0.40708 0.8625
350 3KK 0.406015 0.786517
351 FYN 0.406015 0.804598
352 NVA 2AD 0.405941 0.740741
353 NA0 0.40458 0.907895
354 101 0.404255 0.855263
355 G 0.40404 0.883117
356 5GP 0.40404 0.883117
357 HDV 0.403846 0.87013
358 MGP 0.403846 0.8625
359 OXK 0.402985 0.786517
360 MCD 0.402985 0.786517
361 CA6 0.402985 0.714286
362 SOP 0.402985 0.786517
363 3AD 0.402299 0.783784
364 S8M 0.401869 0.78481
365 YE1 0.40146 0.795455
366 NMX 0.4 0.782609
367 7RP 0.4 0.902778
368 2VA 0.4 0.779221
369 1VU 0.4 0.777778
370 CO6 0.4 0.786517
371 CMC 0.4 0.786517
372 6G0 0.4 0.8625
373 GMV 0.4 0.873418
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2VPQ; Ligand: ANP; Similar sites found with APoc: 468
This union binding pocket(no: 1) in the query (biounit: 2vpq.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
1 4Y93 746 1.12108
2 3LXN MI1 1.25786
3 4GJ3 0XP 1.3245
4 3IGO ANP 1.33038
5 4WNK 453 1.33038
6 5DEY 59T 1.3468
7 6FYL 3NG 1.37741
8 5EZ1 ICB 1.44404
9 4Y9T PA1 1.44509
10 3FHR P4O 1.4881
11 5JSP DQY 1.49254
12 5LPZ ADP 1.50602
13 5HCY 60D 1.51057
14 4GYI ADP 1.51134
15 3UIM ANP 1.53374
16 4U98 ACP 1.55211
17 5LVP ATP 1.60772
18 3RWP ABQ 1.60772
19 2Z49 AMG 1.62037
20 4P5Z Q7M 1.66205
21 4LOO SB4 1.66205
22 3E7O 35F 1.66667
23 4I94 ANP 1.66667
24 1PHK ATP 1.67785
25 4IDT T28 1.68539
26 4KS7 X4Z 1.71233
27 1U5R ATP 1.72414
28 6C0T EE4 1.72911
29 2JDR L20 1.75439
30 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 1.75439
31 5C03 AGS 1.75439
32 3E8N ATP 1.75953
33 3E8N VRA 1.75953
34 2PUL ACP 1.76322
35 5VLQ ANP 1.77384
36 3TTI KBI 1.77384
37 2H8H H8H 1.77384
38 1Y57 MPZ 1.77384
39 6FYV 3NG 1.78042
40 5OMY 9YE 1.79028
41 3KN5 ANP 1.84615
42 5UIU 8CG 1.85759
43 4UXL 5P8 1.86335
44 4WOV 3SM 1.89274
45 4IZY 1J2 1.89702
46 4UX9 ANP 1.92308
47 3VRY B43 1.98238
48 4PZ6 GMP 1.98511
49 6EZ6 C5Z 1.99557
50 5AE9 OKO 1.99557
51 3KAL ADP 1.99557
52 5JIL 6KL 2.06186
53 5DRB 5FJ 2.06186
54 3DAK ANP 2.06897
55 3PE2 E1B 2.07715
56 4BTK DTQ 2.07715
57 4WHZ 3NL 2.07792
58 4WNP 3RJ 2.09059
59 4OH4 ANP 2.1021
60 1TQP ATP 2.12766
61 1Q8Y ADE 2.14477
62 1Q8Y ADP 2.14477
63 3C1X CKK 2.14477
64 4NW6 2NS 2.16718
65 1TZD ADP 2.18182
66 4UTW RFW 2.18341
67 3PTG 932 2.20386
68 2F57 23D 2.2082
69 2YAB AMP 2.21607
70 5OES ADP 2.21729
71 3UDZ ADP 2.21729
72 6FL8 ADP 2.21729
73 6FL8 TIY 2.21729
74 4EUU BX7 2.21729
75 2OBD PCW 2.21729
76 4U0I 0LI 2.22222
77 2QLU ADE 2.2293
78 4XH0 ADP 2.23325
79 3ORK AGS 2.2508
80 1W2D ADP 2.26415
81 1W2D 4IP 2.26415
82 4NFN 2KC 2.26537
83 5AX9 4KT 2.27273
84 3TM0 ANP 2.28137
85 3TM0 B31 2.28137
86 5GZ9 ANP 2.29508
87 2RIO ADP 2.30415
88 5X8I SQZ 2.31214
89 3HAV ATP 2.34114
90 5YF9 NIO 2.35988
91 6G33 5ID 2.35988
92 5LPB ADP 2.36486
93 1M0W ANP 2.43902
94 3SLS ANP 2.43902
95 5MW8 ATP 2.43902
96 5Y86 HRM 2.43902
97 5LXM ADP 2.4735
98 4H3P ANP 2.48619
99 4H3Q ANP 2.48619
100 5BVE 4VG 2.49307
101 5EOB 5QQ 2.50784
102 4NFE BEN 2.53165
103 3PDT ADP 2.54545
104 3CY2 MB9 2.54777
105 5ZTN CUR 2.5641
106 4GLW 0XT 2.62295
107 6BFN DL1 2.63158
108 4USF 6UI 2.63158
109 3MVH WFE 2.63158
110 1EHI ADP 2.65252
111 3GGF GVD 2.65781
112 5DZT AMP 2.66075
113 5WNL STU 2.66075
114 3WVR AMP 2.68456
115 3PLS ANP 2.68456
116 5IH9 6BF 2.68657
117 5JZJ AN2 2.6936
118 2F2U M77 2.73632
119 5DBX ANP 2.7439
120 2Y6O 1N1 2.74914
121 5AWM ANP 2.79188
122 4OUC 5ID 2.80112
123 6G34 5ID 2.80112
124 1S68 AMP 2.81124
125 5YRL GLC GLC 2.8169
126 5KO1 6UY 2.82686
127 4L80 OXL 2.87356
128 2HGS ADP 2.88248
129 4PNI KQQ 2.88248
130 4L9I 8PR 2.88248
131 4FL3 ANP 2.88248
132 4OAV ACP 2.88248
133 4AZW ATP 2.88248
134 4RP9 ASC 2.88248
135 4QTB 38Z 2.89474
136 5JFS 6K0 2.92208
137 5MJA 7O3 2.95082
138 1VJY 460 2.9703
139 2V7O DRN 2.97619
140 2PVF ACP 2.99401
141 4BFM ANP 2.99401
142 5DMZ ADP 3.0137
143 2XMY CDK 3.02013
144 6GQM F8H 3.04878
145 5I35 ANP 3.05344
146 3ALN ANP 3.0581
147 3AKK ADP 3.07692
148 3TKI S25 3.09598
149 4IJP 1EH 3.10421
150 4KRI 1SH 3.10421
151 4OPC FDA 3.10421
152 4OPC PGT 3.10421
153 2HY0 306 3.10559
154 2XK9 XK9 3.10559
155 1V0O INR 3.125
156 3V8S 0HD 3.17073
157 1FAO 4IP 3.1746
158 3VPC ADP 3.19149
159 3I0O ADP 3.24484
160 3KRL KRL 3.28358
161 4BHN BH9 3.29341
162 5EXK 5AD 3.32326
163 6F3G CJN 3.32594
164 3HMO STU 3.32594
165 2JLD AG1 3.33333
166 6GUE FB8 3.35821
167 3SXS PP2 3.35821
168 2GQR ADP 3.37553
169 4K33 ACP 3.38462
170 2BPM 529 3.39623
171 4OCJ NDG 3.43008
172 4BCM T7Z 3.43511
173 4CFU 2WC 3.43511
174 4BCN T9N 3.43511
175 4BCQ TJF 3.43511
176 5USZ SKE 3.46021
177 5VC5 96M 3.46021
178 3E7S AT2 3.48028
179 2R5T ANP 3.48525
180 5UR1 YY9 3.53698
181 2PZI AXX 3.54767
182 4UWH JXM 3.54767
183 2WQN ADP 3.54839
184 3VPB ADP 3.57143
185 3DLS ADP 3.58209
186 4ZS4 ATP 3.58306
187 3TDV GDP 3.59477
188 1BYG STU 3.59712
189 3GC0 AMP 3.64742
190 2BMB PMM 3.66972
191 4OCV ANP 3.69393
192 4NM5 ADP 3.71353
193 6E2O S0L 3.72881
194 3E5A VX6 3.73134
195 3IO3 ADP 3.73563
196 5H2U 1N1 3.74532
197 1CBK ROI 3.75
198 4X7Q 3YR 3.7694
199 5IM3 DTP 3.7694
200 5DXT 5H5 3.7694
201 4CC6 L5Y 3.77358
202 4B1M FRU FRU 3.78378
203 6ES0 BW8 3.78549
204 1LDN OXM 3.79747
205 3FWY ADP 3.82166
206 2FB3 MET 3.82353
207 1U59 STU 3.83275
208 4YZN 4K5 3.83275
209 1IA9 ANP 3.92857
210 3BZ3 YAM 3.98551
211 6GIN IR2 3.98671
212 1O9U ADZ 4
213 3F7Z 34O 4
214 3Q60 ATP 4.04313
215 4CYI ATP 4.10959
216 4E1Z 0MX 4.12371
217 2IF8 ADP 4.13223
218 2X2M X2M 4.14013
219 5N87 N66 4.15335
220 2VZ6 FEF 4.15335
221 5TA6 79D 4.18994
222 4RUS NAG 4.20168
223 2IO8 ADP 4.21286
224 1OPK P16 4.21286
225 4WW7 AMP 4.21456
226 4U44 3D9 4.21687
227 2GQS ADP 4.21941
228 4I6H 1C8 4.22078
229 4G17 0VN 4.24242
230 1ZTH ADP 4.26357
231 1ZP9 ATP 4.26357
232 4Y0X ADP 4.26667
233 4JR7 GNP 4.27807
234 1RE8 BD2 4.28571
235 2QCS ANP 4.28571
236 5T8O 76Z 4.29799
237 2VN9 GVD 4.31894
238 1Z2P ACP 4.32099
239 1Z2P I3S 4.32099
240 2Q7D ANP 4.33526
241 4AT3 LTI 4.34783
242 6CMJ F6J 4.36137
243 4EWH T77 4.36364
244 4OTH DRN 4.39883
245 1GSA ADP 4.43038
246 5QIN J2V 4.43038
247 4FE2 ADP 4.43459
248 2GMH FAD 4.43459
249 1Q8A HCS 4.43459
250 3BOF HCS 4.43459
251 3RI1 3RH 4.47284
252 3FC2 IBI 4.47761
253 3AB4 THR 4.49438
254 6BXI ANP 4.5045
255 4QMN DB8 4.51613
256 2PYW ADP 4.52381
257 4UAL 3FV 4.53461
258 2A19 ANP 4.57143
259 3H9R TAK 4.58716
260 4QM9 CYS 4.62428
261 3KMW ATP 4.65116
262 4MIB 28M 4.65632
263 1E4E ADP 4.66472
264 2ZV2 609 4.69799
265 5M06 ADP 4.71014
266 2WU6 DKI 4.72441
267 2OO8 RAJ 4.73186
268 5U6C 7YS 4.7619
269 4CS9 AMP 4.7619
270 4XVU ATP 4.80226
271 1JPA ANP 4.80769
272 4F9C 0SX 4.86111
273 4N70 2HX 4.87805
274 1R37 ETX 4.89914
275 1ZY5 ANP 4.9505
276 3IDB ANP 4.96894
277 3PP0 03Q 5.02959
278 3RE4 TO1 5.03876
279 2CSN CKI 5.05051
280 5W4W 9WG 5.13595
281 4KBA 1QM 5.13595
282 5VCV 1N1 5.14469
283 4RYV ZEA 5.16129
284 3FHI ANP 5.19481
285 4RDL FUC GAL NDG FUC 5.19481
286 3EKK GS2 5.21173
287 3BU5 ATP 5.22876
288 5NKB 8ZT 5.22876
289 1IR3 ANP 5.22876
290 3GNI ATP 5.27859
291 5YK1 ANP 5.32151
292 2WEI VGG 5.32151
293 4LRJ ANP 5.32544
294 4S00 AKR 5.36913
295 5OKT 9XK 5.41401
296 3SRV S19 5.41516
297 5EFQ ADP 5.4755
298 4F4P 0SB 5.49451
299 4O1P ANP 5.54324
300 3VHE 42Q 5.57103
301 6CGD AKN 5.57377
302 6CGD GNP 5.57377
303 4DFU QUE 5.59006
304 5C4L 4XR 5.60748
305 6GZD LCI 5.61497
306 4A4X JUP 5.73477
307 3GQI ACP 5.75221
308 5EH0 5NW 5.76497
309 4R78 AMP 5.82524
310 4E93 GUI 5.83554
311 5TDF ADP 5.8642
312 1OBD ATP 5.88235
313 2AQX ATP 5.88235
314 3ETH ATP 5.9867
315 4IX4 ADP 6
316 3LXK MI1 6.11621
317 3AQV TAK 6.15942
318 5HES 032 6.18893
319 5CEO 50D 6.20843
320 1CM8 ANP 6.26703
321 4NST ADP 6.26781
322 5HQ0 LZ9 6.29139
323 6GU6 1QK 6.29139
324 2YAK OSV 6.31579
325 4AG8 AXI 6.32911
326 5A6N U7E 6.36042
327 4ASE AV9 6.51558
328 4CSV STI 6.54545
329 4YMJ 4EJ 6.57895
330 3PN1 IVH 6.60377
331 3X01 AMP 6.61578
332 5FBN 5WF 6.64207
333 3G5D 1N1 6.65188
334 2R7K ACP 6.65188
335 2R7K AMZ 6.65188
336 1XJD STU 6.66667
337 1K3A ACP 6.68896
338 1S9D AFB 6.70732
339 6AC9 ANP 6.75676
340 4AU8 Z3R 6.75676
341 5Y80 IRE 6.75676
342 5EYK 5U5 6.77966
343 3TXO 07U 6.79887
344 2D2F ADP 6.8
345 3NW7 LGV 6.84039
346 5CDH TLA 6.84524
347 1UNH IXM 6.84932
348 3O0G 3O0 6.84932
349 2B9J ADP 6.87361
350 2B9H ADP 6.87361
351 2B9I ADP 6.87361
352 2B9F ADP 6.87361
353 4AUA 4AU 6.87361
354 4XZ3 ACP 6.95652
355 5JGA 6KC 6.98413
356 4TWP AXI 7.01107
357 4CLI 5P8 7.03364
358 4DC2 ADE 7.07071
359 1I7L ATP 7.09534
360 4XYM A12 7.09534
361 2PVN P63 7.10227
362 4YZC STU 7.16049
363 4L3L 5FI 7.23684
364 4FG8 ATP 7.30159
365 2WEL K88 7.33333
366 3W0O HY0 7.44986
367 3W0O ADP 7.44986
368 1JBU BEN 7.48031
369 3HRD NIO 7.5
370 5MY8 RXZ 7.5718
371 4NZN 2OU 7.57576
372 4NZN ANP 7.57576
373 3CBC DBS 7.57576
374 5LI1 ANP 7.62712
375 5LXT ACP 7.69231
376 4C2W ANP 7.69231
377 5LI9 ACP 7.71429
378 5EQY 5RA 7.73067
379 2CFM AMP 7.76053
380 4LH7 1X8 8.04954
381 1PK8 ATP 8.05687
382 2QX0 PH2 8.1761
383 1SU2 ATP 8.1761
384 5XVG 8FX 8.19113
385 2GUD BMA 8.19672
386 2GUC MAN 8.19672
387 2NU5 NAG 8.19672
388 2NUO BGC 8.19672
389 2HYR BGC GLC 8.19672
390 2HYQ MAN MAN 8.19672
391 2XVD AS6 8.27815
392 2J7T 274 8.27815
393 2BKK ADP 8.28402
394 5HWK BEZ 8.33333
395 4G31 0WH 8.3612
396 4O4F ATP 8.46774
397 4O4F IHP 8.46774
398 3TII ANP 8.64745
399 2Z7R STU 8.72274
400 3HZT J60 8.86918
401 4ONA UW1 8.8843
402 3GC8 B45 8.91892
403 5WO4 B7V 8.9404
404 3FSY SCA 9.09091
405 4C2V YJA 9.09091
406 1KJ1 MAN 9.17431
407 4Q5H ANP 9.1954
408 2QK4 ATP 9.31264
409 2OFV 242 9.38628
410 5G1X ADP 9.52381
411 4ZGP ADP 9.55631
412 5UKL SIX 9.67742
413 3WUR O4B 9.94152
414 3CF6 SP1 10.1796
415 5CKW ANP 10.1996
416 4Y85 499 10.241
417 6C7Y ADP 10.2564
418 6A1G 9OL 10.2778
419 5TO8 7FM 10.2837
420 3V4S ATP 10.4213
421 3V4S ADP 10.4213
422 4JLS 3ZE 10.5263
423 6BYF CIT 10.5882
424 2RIF AMP 10.6383
425 4Y8D 49J 10.7143
426 2YRX AMP 10.8647
427 5ODT ADP 10.8696
428 4CRL C1I 10.8772
429 5HVJ ANP 11.1111
430 5L8L ADP 11.1111
431 1AUX AGS 11.254
432 4K55 H6P 11.2903
433 4M69 ANP 11.5016
434 3M2W L8I 11.7057
435 3C0G 3AM 11.9658
436 6CQF F97 12.1212
437 5K2M ADP 12.4542
438 4M1U A2G MBG 12.8571
439 2YW2 ATP 13.082
440 3N1S 5GP 14.2857
441 2HK5 1BM 14.4444
442 2GU8 796 15
443 4WB7 ATP 15
444 4WB6 ATP 15
445 4XV1 904 15.7534
446 5ZCT ANP 15.9645
447 4CQE CQE 16.5468
448 5UPK ANP 16.6667
449 3VPD ANP 17.4377
450 1ONI BEZ 18.8406
451 1IOW ADP 18.9542
452 1IOW PHY 18.9542
453 3VOT ADP 19.2941
454 4N7C AEF 19.8864
455 5C1P ADP 20.5882
456 5C1P DAL DAL 20.5882
457 1KJ8 GAR 20.7161
458 1KJ8 ATP 20.7161
459 3ZS9 ADP ALF 21.0526
460 3K5I ADP 23.0769
461 3K5I AIR 23.0769
462 1T36 ADP 23.5033
463 3ORQ ADP 24.1379
464 3LQV ADE 24.3478
465 3WO0 ALA 24.3902
466 3WO0 ADP 24.3902
467 3ZRM ZRM 25
468 3PVW QRX 35.1351
Pocket No.: 2; Query (leader) PDB : 2VPQ; Ligand: ANP; Similar sites found with APoc: 24
This union binding pocket(no: 2) in the query (biounit: 2vpq.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
1 1UO4 PIH None
2 5AMC GLY NIY 1.33038
3 1OFZ FUC 1.60256
4 3THR C2F 2.04778
5 5LXB 7A9 2.47934
6 4DXJ 0M9 2.48619
7 1CKN GTP 2.72727
8 4E03 ADP 2.91262
9 4RFM 3P6 3.00752
10 5CPZ SIA SIA GAL NGA GAL 3.16901
11 3FW3 GLC 3.38346
12 5MU6 KFK 4.09207
13 5MU6 MYA 4.09207
14 5KK4 44E 4.16667
15 1PCA VAL 4.21836
16 5A5W GUO 4.43459
17 3BRN SRO 4.4586
18 3CL7 HYN 4.54545
19 4XTR ATP 4.80226
20 4XTR ADP 4.80226
21 2BS5 BGC GAL FUC 5.55556
22 6FOG OXL 10.2679
23 6E8I PTR 17.7515
24 4M6T SAM 18.0328
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