Receptor
PDB id Resolution Class Description Source Keywords
5OYH 2.25 Å EC: 7.-.-.- CRYSTAL STRUCTURE OF THE CATALYTIC CORE OF A RHODOPSIN-GUANY CYCLASE WITH CONVERTED SPECIFICITY IN COMPLEX WITH ATPALPHA CATENARIA ANGUILLULAE PL171 NUCLEOTIDE CYCLASE INHIBITOR LYASE
Ref.: RHODOPSIN-CYCLASES FOR PHOTOCONTROL OF CGMP/CAMP AN ANGSTROM STRUCTURE OF THE ADENYLYL CYCLASE DOMAIN. NAT COMMUN V. 9 2046 2018
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GOL I:701;
F:701;
E:703;
C:704;
D:702;
A:704;
F:703;
C:701;
O:703;
L:701;
J:701;
K:703;
J:702;
A:703;
G:703;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
T99 I:702;
K:701;
O:701;
G:701;
D:701;
J:703;
C:702;
A:701;
H:701;
N:701;
L:702;
F:702;
B:701;
P:701;
E:701;
M:701;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
523.247 C10 H16 N5 O12 P3 S c1nc(...
CA A:702;
O:702;
M:702;
L:703;
B:702;
G:702;
J:704;
N:702;
E:702;
F:704;
D:703;
C:703;
H:702;
K:702;
I:703;
P:702;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
40.078 Ca [Ca+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5OYH 2.25 Å EC: 7.-.-.- CRYSTAL STRUCTURE OF THE CATALYTIC CORE OF A RHODOPSIN-GUANY CYCLASE WITH CONVERTED SPECIFICITY IN COMPLEX WITH ATPALPHA CATENARIA ANGUILLULAE PL171 NUCLEOTIDE CYCLASE INHIBITOR LYASE
Ref.: RHODOPSIN-CYCLASES FOR PHOTOCONTROL OF CGMP/CAMP AN ANGSTROM STRUCTURE OF THE ADENYLYL CYCLASE DOMAIN. NAT COMMUN V. 9 2046 2018
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 293 families.
1 5OYH - T99 C10 H16 N5 O12 P3 S 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 250 families.
1 5OYH - T99 C10 H16 N5 O12 P3 S 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 204 families.
1 5OYH - T99 C10 H16 N5 O12 P3 S c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: T99; Similar ligands found: 330
No: Ligand ECFP6 Tc MDL keys Tc
1 TAT 1 1
2 T99 1 1
3 ATP 0.794872 0.958904
4 HEJ 0.794872 0.958904
5 AQP 0.78481 0.958904
6 5FA 0.78481 0.958904
7 ADP 0.779221 0.958904
8 AP5 0.75641 0.932432
9 B4P 0.75641 0.932432
10 AT4 0.746835 1
11 AMP 0.746667 0.931507
12 A 0.746667 0.931507
13 BA3 0.74359 0.932432
14 A2D 0.74026 0.932432
15 6YZ 0.729412 0.933333
16 AN2 0.703704 0.945946
17 APC 0.698795 0.921053
18 ABM 0.696203 0.881579
19 M33 0.695122 0.92
20 ACQ 0.694118 0.933333
21 AGS 0.690476 0.986486
22 SAP 0.690476 0.986486
23 ACP 0.686747 0.933333
24 A12 0.679012 0.921053
25 AP2 0.679012 0.921053
26 APR 0.678571 0.932432
27 AR6 0.678571 0.932432
28 CA0 0.674699 0.907895
29 ADX 0.674699 0.8875
30 ANP 0.674419 0.933333
31 SRA 0.670886 0.959459
32 AD9 0.670588 0.933333
33 50T 0.666667 0.92
34 25L 0.659574 0.945946
35 PRX 0.658824 0.858974
36 AU1 0.654762 0.933333
37 ATF 0.640449 0.921053
38 A22 0.637363 0.945946
39 ADV 0.632184 0.896104
40 ADP PO3 0.632184 0.905405
41 RBY 0.632184 0.896104
42 5AL 0.629214 0.894737
43 ADQ 0.623656 0.907895
44 MAP 0.619565 0.909091
45 SRP 0.615385 0.871795
46 JB6 0.614583 0.922078
47 25A 0.612903 0.932432
48 9X8 0.610526 0.934211
49 A1R 0.606383 0.873418
50 A3R 0.606383 0.873418
51 SON 0.604651 0.896104
52 ADP ALF 0.604396 0.8375
53 ALF ADP 0.604396 0.8375
54 GAP 0.6 0.858974
55 VO4 ADP 0.597826 0.894737
56 ADP VO4 0.597826 0.894737
57 7D4 0.597701 0.87013
58 LMS 0.597561 0.841463
59 5SV 0.595745 0.817073
60 OOB 0.595745 0.894737
61 8QN 0.595745 0.894737
62 OAD 0.59375 0.907895
63 PAJ 0.589474 0.851852
64 4AD 0.589474 0.884615
65 AMO 0.589474 0.896104
66 RAB 0.586667 0.810811
67 ADN 0.586667 0.810811
68 XYA 0.586667 0.810811
69 DLL 0.583333 0.894737
70 AHX 0.583333 0.8625
71 00A 0.583333 0.85
72 BIS 0.581633 0.897436
73 3OD 0.581633 0.907895
74 PTJ 0.581633 0.8625
75 ITT 0.579545 0.905405
76 9ZA 0.578947 0.873418
77 9ZD 0.578947 0.873418
78 PAP 0.577778 0.945205
79 3UK 0.57732 0.883117
80 ADP BMA 0.57732 0.883117
81 5AS 0.574713 0.793103
82 G5P 0.572816 0.886076
83 LAD 0.571429 0.829268
84 PR8 0.571429 0.819277
85 B5V 0.571429 0.871795
86 WAQ 0.571429 0.85
87 7D3 0.569767 0.87013
88 DAL AMP 0.568421 0.87013
89 2A5 0.566667 0.883117
90 UP5 0.566038 0.884615
91 FYA 0.565657 0.87013
92 NB8 0.565657 0.8625
93 ME8 0.565657 0.831325
94 TXA 0.565657 0.896104
95 1ZZ 0.565657 0.809524
96 AOC 0.564706 0.789474
97 A4D 0.564103 0.810811
98 G3A 0.563107 0.886076
99 ATR 0.56044 0.931507
100 GAV 0.556701 0.923077
101 9SN 0.554455 0.839506
102 HFD 0.554348 0.909091
103 4UV 0.553398 0.860759
104 DQV 0.552381 0.92
105 GTA 0.552381 0.853659
106 5N5 0.551282 0.786667
107 A4P 0.550459 0.813953
108 FA5 0.54902 0.871795
109 B5Y 0.54902 0.860759
110 B5M 0.54902 0.860759
111 YAP 0.54902 0.860759
112 A3P 0.545455 0.931507
113 5CD 0.544304 0.773333
114 XAH 0.543689 0.809524
115 AFH 0.542857 0.851852
116 7D5 0.542169 0.844156
117 A A 0.54 0.906667
118 3DH 0.535714 0.766234
119 ATP A A A 0.533981 0.893333
120 3AT 0.531915 0.932432
121 MYR AMP 0.529412 0.788235
122 3AM 0.529412 0.891892
123 4UU 0.528302 0.860759
124 GA7 0.528302 0.871795
125 7MD 0.528302 0.831325
126 A2P 0.52809 0.917808
127 48N 0.527778 0.8625
128 AP0 0.527273 0.8625
129 UPA 0.527273 0.873418
130 4TC 0.527273 0.8625
131 T5A 0.526786 0.811765
132 EP4 0.52439 0.725
133 TAD 0.523364 0.898734
134 NXX 0.522936 0.896104
135 TXD 0.522936 0.873418
136 4UW 0.522936 0.829268
137 DND 0.522936 0.896104
138 6V0 0.522936 0.8625
139 NAI 0.522936 0.873418
140 NAX 0.522936 0.841463
141 G5A 0.521277 0.793103
142 LAQ 0.518519 0.876543
143 AHZ 0.518519 0.831325
144 OMR 0.518182 0.821429
145 TXE 0.518182 0.873418
146 DTA 0.518072 0.802632
147 M2T 0.518072 0.728395
148 OVE 0.517241 0.945946
149 DTP 0.515789 0.87013
150 SSA 0.515464 0.813953
151 AR6 AR6 0.514019 0.881579
152 YLP 0.513761 0.790698
153 139 0.513274 0.841463
154 MTA 0.511905 0.766234
155 6AD 0.510417 0.923077
156 PPS 0.510417 0.8875
157 A2R 0.510204 0.945946
158 AMP DBH 0.509434 0.858974
159 TYR AMP 0.509434 0.8375
160 IMO 0.505618 0.891892
161 AV2 0.505155 0.881579
162 A5A 0.505155 0.821429
163 8X1 0.50505 0.766667
164 TSB 0.50505 0.833333
165 5CA 0.50505 0.813953
166 TYM 0.504505 0.871795
167 ADJ 0.5 0.821429
168 2AM 0.5 0.905405
169 YLC 0.5 0.809524
170 V3L 0.5 0.932432
171 6RE 0.5 0.731707
172 COD 0.5 0.804598
173 YLB 0.5 0.790698
174 ARG AMP 0.5 0.8
175 AYB 0.495652 0.781609
176 CNA 0.495652 0.896104
177 54H 0.494949 0.802326
178 52H 0.494949 0.793103
179 VMS 0.494949 0.802326
180 71V 0.494505 0.922078
181 80F 0.491525 0.855422
182 F2R 0.491379 0.833333
183 IOT 0.491228 0.802326
184 AF3 ADP 3PG 0.491071 0.807229
185 53H 0.49 0.793103
186 DAT 0.489362 0.87013
187 5X8 0.489362 0.75641
188 J7C 0.488889 0.740741
189 A3N 0.488889 0.75641
190 ZAS 0.488636 0.7375
191 NAD 0.487179 0.894737
192 YLA 0.486957 0.790698
193 7MC 0.486726 0.811765
194 LPA AMP 0.486486 0.853659
195 DDS 0.484536 0.844156
196 EAD 0.483871 0.841463
197 S4M 0.483516 0.662921
198 P5A 0.480769 0.758242
199 LSS 0.480392 0.775281
200 DSZ 0.480392 0.813953
201 NSS 0.480392 0.813953
202 A3D 0.478992 0.883117
203 MAO 0.478261 0.732558
204 DSH 0.477778 0.719512
205 9K8 0.47619 0.747253
206 NVA LMS 0.475728 0.766667
207 BTX 0.474576 0.855422
208 6C6 0.474227 0.848101
209 LEU LMS 0.471154 0.766667
210 NA7 0.471154 0.921053
211 BT5 0.470588 0.845238
212 7DT 0.46875 0.945205
213 P1H 0.46875 0.821429
214 GJV 0.467391 0.722892
215 YLY 0.467213 0.781609
216 GSU 0.466667 0.793103
217 KAA 0.466667 0.766667
218 AAT 0.464646 0.722892
219 NAE 0.463415 0.860759
220 RGT 0.462963 0.921053
221 8PZ 0.462963 0.813953
222 5AD 0.4625 0.716216
223 G A A A 0.462185 0.839506
224 AMP NAD 0.462185 0.87013
225 4TA 0.462185 0.77907
226 A3G 0.461538 0.769231
227 2SA 0.46 0.896104
228 NAQ 0.459677 0.839506
229 YSA 0.458716 0.793103
230 SFG 0.458333 0.721519
231 DZD 0.458333 0.851852
232 7D7 0.45679 0.714286
233 128 0.45614 0.75
234 N0B 0.456 0.790698
235 ZID 0.456 0.883117
236 M24 0.455285 0.819277
237 6IA 0.454545 0.807229
238 A7D 0.452632 0.769231
239 7DD 0.452632 0.945205
240 U A 0.45082 0.873418
241 NAJ PZO 0.45082 0.817073
242 SA8 0.44898 0.682353
243 A5D 0.44898 0.802632
244 NAJ PYZ 0.448 0.77907
245 MHZ 0.447917 0.674157
246 PGS 0.447917 0.922078
247 N6P 0.447619 0.878378
248 ARU 0.447619 0.829268
249 NDE 0.446154 0.896104
250 D5M 0.445652 0.844156
251 NEC 0.445652 0.717949
252 DA 0.445652 0.844156
253 SAI 0.444444 0.707317
254 SAH 0.444444 0.7375
255 PO4 PO4 A A A A PO4 0.443396 0.866667
256 AVV 0.442308 0.8625
257 SMM 0.441176 0.681818
258 AAM 0.44086 0.931507
259 Y3J 0.440476 0.697368
260 SAM 0.44 0.686047
261 NDC 0.439394 0.839506
262 FB0 0.439394 0.777778
263 C2R 0.438202 0.868421
264 AMZ 0.438202 0.88
265 A G 0.438017 0.85
266 7C5 0.4375 0.7875
267 A3S 0.4375 0.779221
268 EEM 0.435644 0.666667
269 U A G G 0.434426 0.85
270 GGZ 0.432692 0.839506
271 A U 0.432203 0.8375
272 62F 0.431655 0.831325
273 AIR 0.430233 0.864865
274 A A A 0.429907 0.87013
275 4YB 0.429825 0.775281
276 NJP 0.429752 0.909091
277 Z5A 0.429688 0.752809
278 6FA 0.42963 0.811765
279 6K6 0.428571 0.893333
280 NIA 0.428571 0.792683
281 A3T 0.428571 0.789474
282 WSA 0.42735 0.802326
283 S7M 0.427184 0.686047
284 GTP 0.427184 0.884615
285 0WD 0.42623 0.886076
286 12D 0.426087 0.758621
287 QQY 0.423913 0.855263
288 8Q2 0.423729 0.786517
289 FAD 0.423358 0.821429
290 FAS 0.423358 0.821429
291 FDA 0.422222 0.804598
292 8BR 0.421053 0.871795
293 62X 0.420561 0.644444
294 APU 0.420168 0.860759
295 ZDA 0.42 0.831169
296 101 0.419355 0.844156
297 ODP 0.418033 0.875
298 HDV 0.417476 0.858974
299 A6D 0.416667 0.738095
300 K15 0.416667 0.659091
301 V1N 0.415929 0.881579
302 649 0.415254 0.758242
303 S8M 0.415094 0.753086
304 GEK 0.415094 0.731707
305 NPW 0.413223 0.853659
306 NDP 0.413223 0.886076
307 SFD 0.413043 0.765957
308 GDP 0.411765 0.884615
309 0UM 0.411215 0.674419
310 7RA 0.410526 0.918919
311 NZQ 0.409836 0.875
312 TXP 0.409836 0.886076
313 SXZ 0.409091 0.705882
314 ACK 0.408602 0.826667
315 1RB 0.408602 0.849315
316 FAY 0.408451 0.831325
317 COA 0.40625 0.816092
318 NVA 2AD 0.405941 0.731707
319 RFL 0.405594 0.793103
320 TM1 0.405405 0.747126
321 KB1 0.405405 0.674419
322 A C A C 0.404762 0.817073
323 9JJ 0.40411 0.831325
324 3AD 0.402299 0.773333
325 DCA 0.401575 0.795455
326 ETB 0.401575 0.804598
327 FNK 0.401408 0.777778
328 FA9 0.4 0.833333
329 2VA 0.4 0.769231
330 7RP 0.4 0.890411
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 5oyh.bio3) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 5oyh.bio3) has 20 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 5oyh.bio2) has 20 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 5oyh.bio2) has 20 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 5oyh.bio7) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 5oyh.bio7) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 5oyh.bio6) has 20 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 5oyh.bio6) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 5oyh.bio4) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 10; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 10) in the query (biounit: 5oyh.bio4) has 20 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 11; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 11) in the query (biounit: 5oyh.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 12; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 12) in the query (biounit: 5oyh.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 13; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 13) in the query (biounit: 5oyh.bio8) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 14; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 14) in the query (biounit: 5oyh.bio8) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 15; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 15) in the query (biounit: 5oyh.bio5) has 20 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 16; Query (leader) PDB : 5OYH; Ligand: T99; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 16) in the query (biounit: 5oyh.bio5) has 21 residues
No: Leader PDB Ligand Sequence Similarity
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