Receptor
PDB id Resolution Class Description Source Keywords
2P3L 2.2 Å EC: 2.7.7.48 CRYSTAL STRUCTURE OF DENGUE METHYLTRANSFERASE IN COMPLEX WIT AND S-ADENOSYL-L-HOMOCYSTEINE DENGUE VIRUS 2 VIZIER; VIRAL ENZYMES INVOLVED IN REPLICATION; DENGUE VIRUS METHYLTRANSFERASE; STRUCTURAL GENOMICS; MARSEILLES STRUCTURGENOMICS PROGRAM @ AFMB; MSGP VIRAL PROTEINTRANSFERASE
Ref.: STRUCTURAL AND FUNCTIONAL ANALYSIS OF METHYLATION A SEQUENCE REQUIREMENTS OF SHORT CAPPED RNAS BY THE METHYLTRANSFERASE DOMAIN OF DENGUE VIRUS NS5 J.MOL.BIOL. V. 372 723 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CIT A:1003;
Invalid;
none;
submit data
192.124 C6 H8 O7 C(C(=...
G3A A:1002;
Valid;
none;
submit data
772.406 C20 H27 N10 O17 P3 c1nc(...
GOL A:1004;
Invalid;
none;
submit data
92.094 C3 H8 O3 C(C(C...
SAH A:1001;
Valid;
none;
submit data
384.411 C14 H20 N6 O5 S c1nc(...
SO4 A:1005;
A:1006;
A:1007;
A:1008;
A:1009;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2P41 1.8 Å EC: 2.7.7.48 CRYSTAL STRUCTURE OF DENGUE METHYLTRANSFERASE IN COMPLEX WIT 7MEGPPPG2'OME AND S-ADENOSYL-L-HOMOCYSTEINE DENGUE VIRUS 2 VIZIER; VIRAL ENZYMES INVOLVED IN REPLICATION; DENGUE VIRUS METHYLTRANSFERASE; STRUCTURAL GENOMICS; MARSEILLES STRUCTURGENOMICS PROGRAM @ AFMB; MSGP VIRAL PROTEINTRANSFERASE
Ref.: STRUCTURAL AND FUNCTIONAL ANALYSIS OF METHYLATION A SEQUENCE REQUIREMENTS OF SHORT CAPPED RNAS BY THE METHYLTRANSFERASE DOMAIN OF DENGUE VIRUS NS5 J.MOL.BIOL. V. 372 723 2007
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 11 families.
1 2P3L - G3A C20 H27 N10 O17 P3 c1nc(c2c(n....
2 2P41 - G1G C22 H32 N10 O18 P3 Cn1c[n+](c....
3 1L9K - SAH C14 H20 N6 O5 S c1nc(c2c(n....
70% Homology Family (33)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 237 families.
1 2P3L - G3A C20 H27 N10 O17 P3 c1nc(c2c(n....
2 2P41 - G1G C22 H32 N10 O18 P3 Cn1c[n+](c....
3 1L9K - SAH C14 H20 N6 O5 S c1nc(c2c(n....
4 5M5B - SAM C15 H22 N6 O5 S C[S@@+](CC....
5 5GOZ - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
6 5GP1 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
7 5KQR - SAM C15 H22 N6 O5 S C[S@@+](CC....
8 5NJU - SAH C14 H20 N6 O5 S c1nc(c2c(n....
9 5ULP Kd = 24.3 uM KB1 C21 H26 F N7 O5 c1cc(ccc1C....
10 5MRK - SFG C15 H23 N7 O5 c1nc(c2c(n....
11 5NJV - SAM C15 H22 N6 O5 S C[S@@+](CC....
12 5WXB - SAH C14 H20 N6 O5 S c1nc(c2c(n....
13 5KQS - SAM C15 H22 N6 O5 S C[S@@+](CC....
14 3LKZ - SFG C15 H23 N7 O5 c1nc(c2c(n....
15 3EVG - SAH C14 H20 N6 O5 S c1nc(c2c(n....
16 2PX5 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
17 2PXA - SAH C14 H20 N6 O5 S c1nc(c2c(n....
18 2PX8 - MGT C11 H20 N5 O14 P3 CN1CN(C2=C....
19 2PX2 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
20 2PX4 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
21 5E9Q - SAM C15 H22 N6 O5 S C[S@@+](CC....
22 5EHG - 5O0 C20 H16 Cl N3 O6 S c1cc(cc(c1....
23 5EKX - 2CQ C7 H9 Cl N2 Cc1cc(c(cc....
24 4R8S - SFG C15 H23 N7 O5 c1nc(c2c(n....
25 4CTJ - 3A9 C9 H8 O3 c1cc2c(cc1....
26 4CTK - SAM C15 H22 N6 O5 S C[S@@+](CC....
27 5EC8 - 5LP C15 H14 Cl N3 O3 Cc1ccc(c(c....
28 5EIW - X0V C7 H7 F3 N2 c1cc(c(cc1....
29 3P8Z - SAH C14 H20 N6 O5 S c1nc(c2c(n....
30 5CUQ ic50 = 7.7 uM NSC C21 H20 N6 O Cc1cc(c2cc....
31 5EIF - 4M0 C8 H9 N O2 Cc1ccc(c(c....
32 5EHI - 5O3 C20 H17 Cl N4 O5 S c1cc(cc(c1....
33 3P97 - SAM C15 H22 N6 O5 S C[S@@+](CC....
50% Homology Family (47)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3EVA - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 3EVC - SAH C14 H20 N6 O5 S c1nc(c2c(n....
3 3EVF - SAH C14 H20 N6 O5 S c1nc(c2c(n....
4 3EVB - SAH C14 H20 N6 O5 S c1nc(c2c(n....
5 3EVD - SAH C14 H20 N6 O5 S c1nc(c2c(n....
6 3EVE - SAH C14 H20 N6 O5 S c1nc(c2c(n....
7 3ELU - SAM C15 H22 N6 O5 S C[S@@+](CC....
8 3ELW - SAM C15 H22 N6 O5 S C[S@@+](CC....
9 3EMD - SFG C15 H23 N7 O5 c1nc(c2c(n....
10 3ELD - SFG C15 H23 N7 O5 c1nc(c2c(n....
11 3ELY - SAH C14 H20 N6 O5 S c1nc(c2c(n....
12 3EMB - SAM C15 H22 N6 O5 S C[S@@+](CC....
13 2P3L - G3A C20 H27 N10 O17 P3 c1nc(c2c(n....
14 2P41 - G1G C22 H32 N10 O18 P3 Cn1c[n+](c....
15 1L9K - SAH C14 H20 N6 O5 S c1nc(c2c(n....
16 5M5B - SAM C15 H22 N6 O5 S C[S@@+](CC....
17 5GOZ - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
18 5GP1 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
19 5KQR - SAM C15 H22 N6 O5 S C[S@@+](CC....
20 5NJU - SAH C14 H20 N6 O5 S c1nc(c2c(n....
21 5ULP Kd = 24.3 uM KB1 C21 H26 F N7 O5 c1cc(ccc1C....
22 5MRK - SFG C15 H23 N7 O5 c1nc(c2c(n....
23 5NJV - SAM C15 H22 N6 O5 S C[S@@+](CC....
24 5WXB - SAH C14 H20 N6 O5 S c1nc(c2c(n....
25 5KQS - SAM C15 H22 N6 O5 S C[S@@+](CC....
26 3LKZ - SFG C15 H23 N7 O5 c1nc(c2c(n....
27 3EVG - SAH C14 H20 N6 O5 S c1nc(c2c(n....
28 2PX5 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
29 2PXA - SAH C14 H20 N6 O5 S c1nc(c2c(n....
30 2PX8 - MGT C11 H20 N5 O14 P3 CN1CN(C2=C....
31 2PX2 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
32 2PX4 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
33 5E9Q - SAM C15 H22 N6 O5 S C[S@@+](CC....
34 5EHG - 5O0 C20 H16 Cl N3 O6 S c1cc(cc(c1....
35 5EKX - 2CQ C7 H9 Cl N2 Cc1cc(c(cc....
36 4R8S - SFG C15 H23 N7 O5 c1nc(c2c(n....
37 4CTJ - 3A9 C9 H8 O3 c1cc2c(cc1....
38 4CTK - SAM C15 H22 N6 O5 S C[S@@+](CC....
39 5EC8 - 5LP C15 H14 Cl N3 O3 Cc1ccc(c(c....
40 5EIW - X0V C7 H7 F3 N2 c1cc(c(cc1....
41 3P8Z - SAH C14 H20 N6 O5 S c1nc(c2c(n....
42 5CUQ ic50 = 7.7 uM NSC C21 H20 N6 O Cc1cc(c2cc....
43 5EIF - 4M0 C8 H9 N O2 Cc1ccc(c(c....
44 5EHI - 5O3 C20 H17 Cl N4 O5 S c1cc(cc(c1....
45 3P97 - SAM C15 H22 N6 O5 S C[S@@+](CC....
46 3GCZ - SAM C15 H22 N6 O5 S C[S@@+](CC....
47 2WA2 - SAM C15 H22 N6 O5 S C[S@@+](CC....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: G3A; Similar ligands found: 355
No: Ligand ECFP6 Tc MDL keys Tc
1 G3A 1 1
2 G5P 0.988889 1
3 GP3 0.797753 1
4 GTP 0.744681 0.973684
5 GSP 0.729167 0.925
6 BA3 0.719101 0.921053
7 GDP 0.712766 0.973684
8 AP5 0.711111 0.921053
9 B4P 0.711111 0.921053
10 GNH 0.705263 0.961039
11 G1R 0.701031 0.961039
12 GCP 0.701031 0.948718
13 GTA 0.698113 0.962025
14 G A A A 0.690265 0.948718
15 A G 0.690265 0.961039
16 U A G G 0.684211 0.961039
17 5FA 0.680851 0.921053
18 AQP 0.680851 0.921053
19 A2D 0.677778 0.921053
20 5GP 0.677419 0.960526
21 G 0.677419 0.960526
22 9GM 0.676768 0.948718
23 GNP 0.676768 0.948718
24 HEJ 0.670213 0.921053
25 ATP 0.670213 0.921053
26 GTG 0.669811 0.962025
27 GDC 0.660377 0.961538
28 GKE 0.660377 0.961538
29 GDD 0.660377 0.961538
30 G2R 0.660194 0.936709
31 GMV 0.656566 0.948718
32 SAP 0.65625 0.875
33 AGS 0.65625 0.875
34 AT4 0.648936 0.886076
35 GP2 0.642857 0.936709
36 ADP 0.638298 0.921053
37 AN2 0.631579 0.909091
38 GAV 0.631068 0.936709
39 Y9Z 0.62963 0.880952
40 APR 0.628866 0.896104
41 AR6 0.628866 0.896104
42 G2P 0.627451 0.936709
43 ANP 0.626263 0.897436
44 M33 0.625 0.884615
45 GDR 0.623853 0.961538
46 GFB 0.623853 0.961538
47 GPG 0.622642 0.987013
48 AD9 0.622449 0.897436
49 GKD 0.621622 0.961538
50 ACP 0.618557 0.897436
51 6CK 0.618182 0.9375
52 A4P 0.617391 0.892857
53 ACQ 0.61 0.897436
54 CA0 0.608247 0.897436
55 ALF 5GP 0.607843 0.86747
56 6YZ 0.607843 0.897436
57 JB2 0.607143 0.961538
58 YGP 0.605505 0.902439
59 UP5 0.605263 0.898734
60 GDX 0.60177 0.974026
61 GPD 0.60177 0.925926
62 A1R 0.6 0.841463
63 ATF 0.598039 0.886076
64 CAG 0.595041 0.904762
65 ADX 0.591837 0.811765
66 AMP 0.591398 0.894737
67 A 0.591398 0.894737
68 APC G U 0.590164 0.911392
69 JB3 0.589744 0.949367
70 GDP AF3 0.588785 0.86747
71 50T 0.585859 0.884615
72 ADQ 0.584906 0.897436
73 A3R 0.584906 0.841463
74 A22 0.580952 0.934211
75 PRX 0.58 0.82716
76 T5A 0.579832 0.825581
77 TPG 0.579365 0.842697
78 GDP ALF 0.574074 0.86747
79 ALF GDP 0.574074 0.86747
80 ABM 0.572917 0.848101
81 5AL 0.572816 0.884615
82 25L 0.572727 0.934211
83 NGD 0.571429 0.987013
84 2MD 0.570248 0.892857
85 4AD 0.570093 0.875
86 0O2 0.563636 0.960526
87 TAT 0.563107 0.886076
88 T99 0.563107 0.886076
89 SRP 0.561905 0.8625
90 AP2 0.561224 0.886076
91 A12 0.561224 0.886076
92 8QN 0.560748 0.884615
93 OAD 0.559633 0.897436
94 9X8 0.559633 0.851852
95 GMP 0.55914 0.857143
96 MGD 0.556452 0.892857
97 4TC 0.554622 0.876543
98 SRA 0.552083 0.85
99 00A 0.550459 0.864198
100 3OD 0.54955 0.897436
101 BIS 0.54955 0.864198
102 APC 0.54902 0.886076
103 OOB 0.546296 0.909091
104 5SV 0.546296 0.788235
105 U2G 0.545455 0.9375
106 FEG 0.545455 0.903614
107 AU1 0.544554 0.897436
108 AMO 0.541284 0.886076
109 PAJ 0.541284 0.843373
110 ZGP 0.540984 0.892857
111 139 0.540984 0.855422
112 LAD 0.540541 0.821429
113 WAQ 0.540541 0.841463
114 PR8 0.540541 0.811765
115 1YD 0.53913 0.947368
116 4BW 0.53913 0.947368
117 G G 0.53913 0.974026
118 G3D 0.537037 0.960526
119 MAP 0.537037 0.875
120 CG2 0.536585 0.9375
121 DLL 0.536364 0.909091
122 1ZZ 0.535714 0.802326
123 A G U 0.532847 0.91358
124 25A 0.53211 0.921053
125 3UK 0.531532 0.922078
126 GDP 7MG 0.529915 0.936709
127 UPA 0.528926 0.8875
128 RBY 0.528846 0.8625
129 ADP PO3 0.528846 0.87013
130 ADV 0.528846 0.8625
131 G4P 0.527273 0.960526
132 MD1 0.527132 0.892857
133 PGD 0.527132 0.925926
134 B5V 0.526786 0.910256
135 9SN 0.526316 0.876543
136 4UV 0.525862 0.875
137 DND 0.525 0.910256
138 NXX 0.525 0.910256
139 AHX 0.522523 0.853659
140 NB8 0.522124 0.853659
141 TXA 0.522124 0.886076
142 PTJ 0.522124 0.853659
143 ME8 0.522124 0.802326
144 B5Y 0.521739 0.898734
145 TXE 0.520661 0.8875
146 FE9 0.51938 0.778947
147 GH3 0.518182 0.948052
148 4UU 0.516949 0.875
149 AFH 0.516949 0.843373
150 7D4 0.514563 0.8375
151 A G U U 0.514085 0.91358
152 DQV 0.512605 0.934211
153 4UW 0.512397 0.843373
154 TXD 0.512397 0.8875
155 3GP 0.509804 0.922078
156 ALF ADP 0.509259 0.807229
157 ADP ALF 0.509259 0.807229
158 FYA 0.508772 0.860759
159 YAP 0.508621 0.875
160 FA5 0.508621 0.886076
161 B5M 0.508621 0.898734
162 OMR 0.508197 0.813953
163 G1R G1R 0.507576 0.949367
164 DBG 0.507576 0.974359
165 SON 0.504854 0.886076
166 GAP 0.504673 0.85
167 ADP VO4 0.504587 0.860759
168 VO4 ADP 0.504587 0.860759
169 YLP 0.504132 0.784091
170 48N 0.504132 0.9
171 G4M 0.503597 0.904762
172 NAI 0.5 0.8875
173 NAX 0.5 0.855422
174 ITT 0.5 0.87013
175 6V0 0.5 0.876543
176 DGT 0.5 0.9
177 JBT 0.497076 0.8
178 F2R 0.496063 0.891566
179 DAL AMP 0.495495 0.860759
180 LMS 0.494949 0.770115
181 ADJ 0.492063 0.813953
182 YLB 0.491935 0.784091
183 YLC 0.491935 0.802326
184 AP0 0.491935 0.853659
185 XAH 0.491525 0.802326
186 9ZA 0.491071 0.864198
187 9ZD 0.491071 0.864198
188 G1G 0.48855 0.95
189 CNA 0.488189 0.910256
190 4UR 0.488 0.947368
191 TYM 0.483871 0.886076
192 LAQ 0.483607 0.802326
193 1YC 0.483333 0.921053
194 HFD 0.481481 0.875
195 2GP 0.480769 0.935065
196 NAD 0.48062 0.909091
197 YLA 0.480315 0.784091
198 GA7 0.479339 0.8625
199 GCP G 0.478632 0.897436
200 ADP BMA 0.478261 0.873418
201 6G0 0.477477 0.936709
202 2A5 0.476636 0.85
203 AYB 0.476562 0.775281
204 7D3 0.475728 0.8375
205 A A 0.474138 0.896104
206 A3D 0.473282 0.897436
207 A2R 0.473214 0.909091
208 IOT 0.472441 0.858824
209 PAP 0.472222 0.907895
210 ATR 0.472222 0.894737
211 AOC 0.470588 0.759494
212 JB6 0.470085 0.841463
213 GPX 0.469565 0.922078
214 COD 0.469231 0.777778
215 MGP 0.468468 0.936709
216 5AS 0.466667 0.728261
217 MYR AMP 0.466102 0.781609
218 BT5 0.465649 0.795455
219 3AT 0.463636 0.896104
220 DGI 0.463636 0.9
221 YLY 0.462687 0.775281
222 RAB 0.462366 0.779221
223 XYA 0.462366 0.779221
224 ADN 0.462366 0.779221
225 80F 0.462121 0.825581
226 FDA 0.461538 0.83908
227 AKW 0.460938 0.914634
228 PGD O 0.459854 0.852273
229 7C5 0.459016 0.896104
230 IDP 0.458716 0.947368
231 U A 0.458647 0.8875
232 6FA 0.458333 0.891566
233 ATP A A A 0.458333 0.883117
234 4TA 0.458015 0.793103
235 BTX 0.458015 0.804598
236 EAD 0.456522 0.855422
237 R7I 0.455357 0.922078
238 R5I 0.455357 0.922078
239 AR6 AR6 0.455285 0.871795
240 ARG AMP 0.455285 0.857143
241 5N5 0.452632 0.75641
242 ZID 0.452555 0.922078
243 N0B 0.452555 0.804598
244 FAS 0.452055 0.902439
245 FAD 0.452055 0.902439
246 M24 0.451852 0.855422
247 TYR AMP 0.45082 0.851852
248 7D5 0.45 0.8125
249 BGO 0.449612 0.949367
250 P1G 0.449541 0.85
251 EP4 0.44898 0.698795
252 NAE 0.448529 0.898734
253 AHZ 0.448 0.802326
254 5CD 0.447917 0.74359
255 A4D 0.447917 0.75641
256 FAY 0.446667 0.91358
257 NAQ 0.445255 0.876543
258 ARU 0.444444 0.8
259 P2G 0.444444 0.860759
260 P1H 0.443662 0.835294
261 TSB 0.443478 0.784091
262 8X1 0.443478 0.723404
263 A3P 0.443396 0.894737
264 SFD 0.442177 0.778947
265 G5A 0.441441 0.747253
266 3AM 0.441176 0.857143
267 NA7 0.440678 0.886076
268 TAD 0.44 0.843373
269 GGM 0.439394 0.925926
270 AMP DBH 0.439024 0.873418
271 SSA 0.438596 0.766667
272 DTP 0.4375 0.8375
273 AF3 ADP 3PG 0.4375 0.8
274 P5A 0.436975 0.715789
275 AMP NAD 0.43609 0.884615
276 DG 0.435185 0.8875
277 DGP 0.435185 0.8875
278 G U 0.435115 0.901235
279 VMS 0.434783 0.755556
280 54H 0.434783 0.755556
281 RFL 0.434211 0.870588
282 6AD 0.433628 0.843373
283 PPS 0.433628 0.811765
284 7MD 0.432 0.823529
285 3DH 0.431373 0.716049
286 FNK 0.430464 0.811111
287 M2T 0.43 0.682353
288 DTA 0.43 0.75
289 A2P 0.429907 0.881579
290 MAO 0.429907 0.707865
291 A5A 0.429825 0.772727
292 GPC 0.42963 0.880952
293 Z5A 0.428571 0.786517
294 ODP 0.428571 0.936709
295 G C 0.428571 0.901235
296 NDC 0.427586 0.876543
297 FB0 0.427586 0.771739
298 AVV 0.42735 0.831325
299 NAJ PZO 0.426471 0.831325
300 IMP 0.425926 0.934211
301 MTA 0.425743 0.716049
302 DDS 0.424779 0.8125
303 V3L 0.424779 0.896104
304 NSS 0.423729 0.766667
305 NDE 0.423611 0.935065
306 52H 0.422414 0.747253
307 DZD 0.422222 0.865854
308 LPA AMP 0.421875 0.781609
309 9K8 0.421488 0.723404
310 PUA 0.42029 0.865854
311 NVA LMS 0.420168 0.723404
312 APU 0.419847 0.875
313 6RE 0.419048 0.768293
314 5CA 0.418803 0.766667
315 53H 0.418803 0.747253
316 128 0.418605 0.784091
317 NJP 0.41791 0.923077
318 P5F 0.417722 0.872093
319 AV2 0.417391 0.848101
320 LEU LMS 0.416667 0.723404
321 G2Q 0.416667 0.936709
322 7MC 0.412214 0.804598
323 LSS 0.411765 0.731183
324 DSZ 0.411765 0.766667
325 RGT 0.41129 0.910256
326 A3N 0.411215 0.728395
327 IMO 0.411215 0.857143
328 J7C 0.411215 0.777778
329 7DT 0.410714 0.907895
330 ZAS 0.409524 0.731707
331 A U 0.409091 0.851852
332 G7M 0.409091 0.924051
333 GJV 0.407407 0.759036
334 S4M 0.407407 0.623656
335 SA8 0.40708 0.678161
336 OVE 0.40566 0.8375
337 SGP 0.405405 0.807229
338 MHZ 0.405405 0.652174
339 0WD 0.404412 0.9
340 NAJ PYZ 0.404255 0.793103
341 2AM 0.403846 0.87013
342 F2N 0.403727 0.820225
343 C2E 0.403509 0.947368
344 35G 0.403509 0.934211
345 PCG 0.403509 0.934211
346 J1A 0.402878 0.75
347 DSH 0.401869 0.674419
348 5X8 0.401786 0.728395
349 DAT 0.401786 0.8375
350 KAA 0.401639 0.723404
351 GSU 0.401639 0.747253
352 01G 0.4 0.903614
353 TXP 0.4 0.9
354 5GP 5GP 0.4 0.909091
355 G G G C 0.4 0.9375
Ligand no: 2; Ligand: SAH; Similar ligands found: 211
No: Ligand ECFP6 Tc MDL keys Tc
1 SAH 1 1
2 5X8 0.759494 0.969697
3 A7D 0.734177 0.926471
4 TT8 0.709302 0.970588
5 DSH 0.692308 0.914286
6 SXZ 0.692308 0.916667
7 DTA 0.666667 0.857143
8 3DH 0.662338 0.869565
9 S8M 0.655556 0.901408
10 SFG 0.635294 0.954545
11 SA8 0.62069 0.915493
12 EEM 0.617977 0.890411
13 MTA 0.615385 0.869565
14 SAI 0.613636 0.955882
15 S7M 0.586957 0.916667
16 36A 0.586538 0.90411
17 K15 0.583333 0.878378
18 ADN 0.573333 0.84058
19 RAB 0.573333 0.84058
20 XYA 0.573333 0.84058
21 62X 0.572917 0.855263
22 5CD 0.571429 0.852941
23 0UM 0.5625 0.876712
24 5N5 0.558442 0.84058
25 A4D 0.551282 0.867647
26 SAM 0.537634 0.916667
27 SMM 0.536842 0.88
28 SSA 0.536842 0.712644
29 KB1 0.534653 0.902778
30 A5D 0.532609 0.857143
31 SIB 0.53125 0.928571
32 EP4 0.530864 0.819444
33 DSZ 0.530612 0.732558
34 GSU 0.53 0.752941
35 A 0.529412 0.763158
36 LMS 0.529412 0.694118
37 AMP 0.529412 0.763158
38 5CA 0.525773 0.712644
39 ME8 0.524752 0.8125
40 M2T 0.52439 0.821918
41 6RE 0.523256 0.824324
42 GJV 0.522727 0.813333
43 AAT 0.515789 0.863014
44 LSS 0.515152 0.696629
45 KAA 0.514852 0.727273
46 J7C 0.511364 0.835616
47 A5A 0.510417 0.697674
48 SON 0.505495 0.805195
49 SRP 0.505155 0.805195
50 F0P 0.504505 0.915493
51 54H 0.5 0.681818
52 VMS 0.5 0.681818
53 ADX 0.5 0.694118
54 CA0 0.5 0.769231
55 AMO 0.5 0.805195
56 5AL 0.5 0.779221
57 KH3 0.5 0.866667
58 NVA LMS 0.49505 0.707865
59 AHX 0.49505 0.753086
60 TSB 0.494949 0.689655
61 53H 0.494949 0.674157
62 G5A 0.494737 0.712644
63 ABM 0.494382 0.74359
64 A2D 0.494382 0.74359
65 ZAS 0.494253 0.808219
66 A6D 0.490196 0.759494
67 8QN 0.49 0.779221
68 GEK 0.49 0.956522
69 GAP 0.489583 0.769231
70 AN2 0.48913 0.734177
71 A3S 0.48913 0.884058
72 S4M 0.488889 0.831169
73 SRA 0.488636 0.746835
74 LAD 0.485437 0.810127
75 52H 0.484848 0.674157
76 A12 0.483516 0.759494
77 BA3 0.483516 0.74359
78 AP2 0.483516 0.759494
79 NEC 0.483146 0.788732
80 AOC 0.483146 0.842857
81 Y3J 0.481481 0.768116
82 VRT 0.479167 0.861111
83 50T 0.478723 0.734177
84 B4P 0.478261 0.74359
85 ADP 0.478261 0.74359
86 5AS 0.478261 0.655556
87 AP5 0.478261 0.74359
88 A3N 0.477778 0.830986
89 YSA 0.476636 0.712644
90 XAH 0.476636 0.768293
91 0XU 0.473684 0.897059
92 AT4 0.473118 0.7375
93 WAQ 0.471154 0.807692
94 NSS 0.470588 0.712644
95 5AD 0.468354 0.791045
96 AU1 0.468085 0.725
97 M33 0.468085 0.734177
98 MAO 0.467391 0.797468
99 TXA 0.466667 0.759494
100 NB8 0.466667 0.775
101 A3G 0.466667 0.871429
102 3AM 0.465909 0.727273
103 DAL AMP 0.465347 0.779221
104 8X1 0.465347 0.707865
105 A3T 0.463158 0.842857
106 ATP 0.463158 0.74359
107 HEJ 0.463158 0.74359
108 ACP 0.463158 0.746835
109 7D7 0.4625 0.785714
110 LEU LMS 0.461538 0.688889
111 9ZA 0.460784 0.740741
112 9ZD 0.460784 0.740741
113 5FA 0.458333 0.74359
114 AQP 0.458333 0.74359
115 AR6 0.458333 0.766234
116 APC 0.458333 0.759494
117 APR 0.458333 0.766234
118 PRX 0.458333 0.746835
119 F2R 0.457627 0.75
120 IOT 0.456897 0.761905
121 4AD 0.456311 0.794872
122 PAJ 0.456311 0.722892
123 WSA 0.45614 0.72093
124 YAP 0.453704 0.794872
125 8PZ 0.453704 0.712644
126 FA5 0.453704 0.805195
127 ADP PO3 0.453608 0.763158
128 ADV 0.453608 0.782051
129 NVA 2AD 0.453608 0.849315
130 SAP 0.453608 0.728395
131 AGS 0.453608 0.728395
132 RBY 0.453608 0.782051
133 AD9 0.453608 0.725
134 PTJ 0.45283 0.731707
135 MHZ 0.452632 0.797468
136 00A 0.451923 0.740741
137 A3P 0.451613 0.74026
138 YLP 0.451327 0.771084
139 7MD 0.45045 0.768293
140 ALF ADP 0.45 0.707317
141 ADP ALF 0.45 0.707317
142 2VA 0.447917 0.819444
143 OOB 0.446602 0.779221
144 ANP 0.444444 0.725
145 T99 0.444444 0.7375
146 ACQ 0.444444 0.746835
147 TAT 0.444444 0.7375
148 P5A 0.443396 0.719101
149 7D5 0.443182 0.708861
150 A1R 0.442308 0.7625
151 YLC 0.439655 0.790123
152 2AM 0.438202 0.717949
153 DLL 0.438095 0.779221
154 ARG AMP 0.4375 0.759036
155 A22 0.436893 0.734177
156 D3Y 0.436893 0.859155
157 ATF 0.435644 0.716049
158 MYR AMP 0.435185 0.746988
159 80F 0.434426 0.75
160 SO8 0.434343 0.808219
161 OAD 0.433962 0.769231
162 3UK 0.433962 0.769231
163 TAD 0.433628 0.765432
164 25A 0.432692 0.74359
165 6YZ 0.431373 0.746835
166 VO4 ADP 0.431373 0.734177
167 ADP VO4 0.431373 0.734177
168 9SN 0.431193 0.731707
169 TYM 0.431034 0.805195
170 B5V 0.429907 0.759494
171 PR8 0.429907 0.8
172 ADQ 0.428571 0.746835
173 YLB 0.42735 0.771084
174 9K8 0.425926 0.67033
175 1ZZ 0.425926 0.746988
176 FYA 0.425926 0.779221
177 3OD 0.425926 0.769231
178 PPS 0.425743 0.674419
179 MAP 0.423077 0.707317
180 A2P 0.421053 0.727273
181 4YB 0.421053 0.735632
182 9X8 0.420561 0.75
183 ADP BMA 0.420561 0.746835
184 TYR AMP 0.419643 0.794872
185 5SV 0.419048 0.731707
186 3NZ 0.416667 0.824324
187 YLA 0.416667 0.771084
188 8Q2 0.415254 0.688889
189 A3R 0.415094 0.7625
190 B5Y 0.414414 0.75
191 B5M 0.414414 0.75
192 48N 0.413793 0.753086
193 LPA AMP 0.413793 0.768293
194 AYB 0.413223 0.761905
195 ACK 0.413043 0.710526
196 QQY 0.413043 0.696203
197 BIS 0.412844 0.719512
198 JB6 0.412844 0.7625
199 PAP 0.41 0.730769
200 DQV 0.408696 0.75641
201 OVE 0.408602 0.7125
202 AMP DBH 0.40708 0.746835
203 4UV 0.40708 0.75
204 3AD 0.406977 0.852941
205 AF3 ADP 3PG 0.40678 0.743902
206 OMR 0.40678 0.738095
207 LAQ 0.405172 0.768293
208 A A 0.40367 0.74359
209 7C5 0.403509 0.789474
210 7MC 0.403361 0.75
211 4UU 0.4 0.75
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2P41; Ligand: SAH; 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: 2p41.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2P41; Ligand: G1G; 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: 2p41.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 2P41; Ligand: SAH; 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: 2p41.bio2) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 2P41; Ligand: SAH; 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: 2p41.bio2) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 2P41; Ligand: G1G; 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: 2p41.bio2) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 2P41; Ligand: G1G; 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: 2p41.bio2) has 15 residues
No: Leader PDB Ligand Sequence Similarity
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