Receptor
PDB id Resolution Class Description Source Keywords
3PUV 2.4 Å EC: 3.6.3.19 CRYSTAL STRUCTURE OF AN OUTWARD-FACING MBP-MALTOSE TRANSPORT BOUND TO ADP-VO4 ESCHERICHIA COLI ATP BINDING CASSETTE NUCLEOTIDE BINDING DOMAIN SUBSTRATE BPROTEIN ABC TRANSPORTER IMPORTER ATPASE ATP BINDING MALTODEXTRIN BINDING TRANSMEMBRANE INTEGRAL MEMBRANE HYDRTRANSPORT PROTEIN COMPLEX
Ref.: SNAPSHOTS OF THE MALTOSE TRANSPORTER DURING ATP HYD PROC.NATL.ACAD.SCI.USA V. 108 15152 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADP VO4 B:2502;
A:2501;
Valid;
Valid;
none;
none;
submit data
540.125 n/a [V](O...
MG A:1501;
B:1502;
Part of Protein;
Part of Protein;
none;
none;
submit data
24.305 Mg [Mg+2...
PGV F:4001;
F:4002;
F:4008;
F:4010;
G:4003;
G:4004;
G:4005;
G:4006;
G:4007;
G:4009;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
749.007 C40 H77 O10 P CCCCC...
UMQ F:5004;
Invalid;
none;
submit data
496.589 C23 H44 O11 CCCCC...
GLC GLC C:1;
Valid;
none;
submit data
342.297 n/a O(C1O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3RLF 2.2 Å EC: 3.6.3.19 CRYSTAL STRUCTURE OF THE MALTOSE-BINDING PROTEIN/MALTOSE TRA COMPLEX IN AN OUTWARD-FACING CONFORMATION BOUND TO MGAMPPNP ESCHERICHIA COLI INTEGRAL MEMBRANE PROTEIN ATPASE ABC TRANSPORTER MEMBRANETRANSMEMBRANE HYDROLASE-TRANSPORT PROTEIN COMPLEX
Ref.: SNAPSHOTS OF THE MALTOSE TRANSPORTER DURING ATP HYD PROC.NATL.ACAD.SCI.USA V. 108 15152 2011
Members (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3RLF - GLC GLC n/a n/a
2 3PUV - GLC GLC n/a n/a
3 3PUW - GLC GLC n/a n/a
4 3PUX - GLC GLC n/a n/a
5 4KI0 - GLC GLC GLC GLC n/a n/a
70% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3RLF - GLC GLC n/a n/a
2 3PUV - GLC GLC n/a n/a
3 3PUW - GLC GLC n/a n/a
4 3PUX - GLC GLC n/a n/a
5 4KI0 - GLC GLC GLC GLC n/a n/a
50% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3RLF - GLC GLC n/a n/a
2 3PUV - GLC GLC n/a n/a
3 3PUW - GLC GLC n/a n/a
4 3PUX - GLC GLC n/a n/a
5 4KI0 - GLC GLC GLC GLC n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ADP VO4; Similar ligands found: 325
No: Ligand ECFP6 Tc MDL keys Tc
1 VO4 ADP 1 1
2 ADP VO4 1 1
3 ADP PO3 0.790123 0.957747
4 ATP MG 0.790123 0.957747
5 ADP MG 0.78481 0.957747
6 ADP ALF 0.752941 0.907895
7 ALF ADP 0.752941 0.907895
8 ADP BMA 0.695652 0.906667
9 GAP 0.689655 0.906667
10 ATP A A A 0.677083 0.944444
11 ATP A 0.677083 0.944444
12 A 0.675 0.930556
13 AMP 0.675 0.930556
14 A2D 0.670732 0.931507
15 ADP 0.666667 0.931507
16 50T 0.662791 0.945205
17 BA3 0.654762 0.931507
18 DAL AMP 0.652174 0.918919
19 M33 0.651163 0.918919
20 45A 0.650602 0.905405
21 ABM 0.650602 0.905405
22 APC MG 0.647727 0.931507
23 B4P 0.647059 0.931507
24 AP5 0.647059 0.931507
25 AT4 0.639535 0.894737
26 AN2 0.639535 0.918919
27 A12 0.635294 0.894737
28 AP2 0.635294 0.894737
29 AR6 AR6 0.633663 0.931507
30 AGS 0.629214 0.883117
31 SAP 0.629214 0.883117
32 SRA 0.626506 0.881579
33 ACP 0.625 0.906667
34 HEJ 0.625 0.931507
35 ATP 0.625 0.931507
36 AHZ 0.621359 0.829268
37 A A 0.618557 0.931507
38 AR6 0.617977 0.931507
39 APC 0.617977 0.894737
40 5FA 0.617977 0.931507
41 AQP 0.617977 0.931507
42 APR 0.617977 0.931507
43 CA0 0.613636 0.906667
44 ADX 0.613636 0.839506
45 AU1 0.613636 0.906667
46 AD9 0.611111 0.958904
47 KG4 0.606742 0.906667
48 AF3 ADP 3PG 0.603774 0.873418
49 PRX 0.6 0.881579
50 ANP 0.597826 0.906667
51 T99 0.597826 0.894737
52 ACQ 0.597826 0.906667
53 TAT 0.597826 0.894737
54 RBY 0.593407 0.894737
55 ADV 0.593407 0.894737
56 MYR AMP 0.59 0.829268
57 H1Q 0.588889 0.971831
58 ATF 0.585106 0.894737
59 TYR AMP 0.582524 0.883117
60 6YZ 0.578947 0.906667
61 SRP 0.578947 0.894737
62 OZV 0.57732 0.931507
63 LMS 0.576471 0.817073
64 8LE 0.574468 0.883117
65 5AL 0.574468 0.918919
66 HQG 0.572917 0.918919
67 ARG AMP 0.571429 0.819277
68 AMP DBH 0.567308 0.881579
69 A22 0.56701 0.918919
70 MAP 0.56701 0.907895
71 SON 0.566667 0.894737
72 4TA 0.566372 0.819277
73 AMP NAD 0.566372 0.918919
74 8LH 0.5625 0.894737
75 5SV 0.561224 0.8375
76 PO4 PO4 A A A A PO4 0.56 0.916667
77 9X8 0.56 0.883117
78 ADQ 0.555556 0.906667
79 4AD 0.555556 0.907895
80 LPA AMP 0.555556 0.829268
81 A1R 0.555556 0.871795
82 A3R 0.555556 0.871795
83 NAJ PZO 0.551724 0.860759
84 8LQ 0.55102 0.894737
85 8QN 0.545455 0.918919
86 9ZA 0.545455 0.871795
87 9ZD 0.545455 0.871795
88 AOC 0.545455 0.810811
89 25A 0.545455 0.931507
90 OOB 0.545455 0.918919
91 OAD 0.544554 0.906667
92 XYA 0.544304 0.808219
93 ADN 0.544304 0.808219
94 RAB 0.544304 0.808219
95 PAJ 0.54 0.85
96 AMO 0.54 0.894737
97 NAD 0.53913 0.945205
98 5AS 0.538462 0.770115
99 DLL 0.534653 0.918919
100 AHX 0.534653 0.860759
101 00A 0.534653 0.871795
102 3OD 0.533981 0.906667
103 BIS 0.533981 0.871795
104 NAJ PYZ 0.533333 0.819277
105 5N5 0.530864 0.783784
106 A3D 0.529915 0.932432
107 3UK 0.529412 0.906667
108 25L 0.528846 0.918919
109 AFH 0.527778 0.85
110 Z5A 0.52459 0.790698
111 5CD 0.52439 0.794521
112 A4D 0.52439 0.783784
113 B5V 0.524272 0.894737
114 WAQ 0.524272 0.871795
115 PR8 0.524272 0.839506
116 LAD 0.524272 0.85
117 9SN 0.52381 0.860759
118 NAI 0.522523 0.871795
119 G5A 0.520833 0.770115
120 1ZZ 0.519231 0.829268
121 JB6 0.519231 0.871795
122 FYA 0.519231 0.893333
123 TXA 0.519231 0.894737
124 PTJ 0.519231 0.860759
125 NB8 0.519231 0.860759
126 ME8 0.519231 0.829268
127 TXE 0.517857 0.871795
128 DTA 0.517647 0.776316
129 G A A A 0.512821 0.860759
130 NAE 0.512397 0.907895
131 A3P 0.51087 0.930556
132 PAP 0.510417 0.917808
133 4UV 0.509259 0.883117
134 NAX 0.508929 0.839506
135 NAQ 0.508197 0.884615
136 EP4 0.505882 0.74359
137 B5M 0.504673 0.883117
138 B5Y 0.504673 0.883117
139 FA5 0.504673 0.894737
140 YAP 0.504673 0.883117
141 G3A 0.504587 0.860759
142 ZID 0.504065 0.932432
143 NMN AMP PO4 0.5 0.883117
144 3DH 0.5 0.763158
145 4UU 0.5 0.883117
146 G5P 0.5 0.860759
147 A G 0.5 0.871795
148 XAH 0.5 0.829268
149 M2T 0.5 0.746835
150 AP0 0.5 0.860759
151 U A G G 0.495798 0.871795
152 TXD 0.495575 0.871795
153 GTA 0.495495 0.851852
154 DQV 0.495495 0.918919
155 3AM 0.494382 0.890411
156 MTA 0.494253 0.763158
157 LAQ 0.491071 0.829268
158 TSB 0.490196 0.788235
159 A5A 0.49 0.797619
160 A3N 0.48913 0.753247
161 7D5 0.488636 0.842105
162 U A 0.487603 0.896104
163 YLP 0.486726 0.809524
164 48N 0.486726 0.860759
165 7MD 0.486486 0.829268
166 GA7 0.486486 0.87013
167 A A A 0.485714 0.918919
168 SSA 0.485149 0.770115
169 2A5 0.484536 0.857143
170 7D3 0.483871 0.844156
171 S4M 0.483871 0.678161
172 6RE 0.483516 0.75
173 NXX 0.482456 0.92
174 6V0 0.482456 0.860759
175 DND 0.482456 0.92
176 4UW 0.482456 0.85
177 UP5 0.482456 0.883117
178 TAD 0.482143 0.85
179 LSS 0.480769 0.752809
180 NSS 0.480769 0.790698
181 NDE 0.48062 0.92
182 VMS 0.480392 0.77907
183 54H 0.480392 0.77907
184 52H 0.480392 0.770115
185 ATR 0.479592 0.90411
186 A2P 0.478723 0.916667
187 TYM 0.478261 0.894737
188 OMR 0.478261 0.819277
189 NVA LMS 0.47619 0.764045
190 8X1 0.475728 0.744444
191 5CA 0.475728 0.770115
192 53H 0.475728 0.770115
193 N01 0.47541 0.918919
194 139 0.474576 0.839506
195 4TC 0.474138 0.860759
196 NDC 0.473282 0.884615
197 J7C 0.473118 0.7375
198 ZAS 0.472527 0.779221
199 LEU LMS 0.471698 0.764045
200 A U 0.470085 0.883117
201 A4P 0.470085 0.790698
202 P5A 0.46729 0.736264
203 ENQ 0.46729 0.90411
204 DSZ 0.466667 0.770115
205 F2R 0.466667 0.809524
206 PPS 0.465347 0.817073
207 7D4 0.463918 0.844156
208 8PZ 0.463636 0.770115
209 MAO 0.463158 0.75
210 9K8 0.462963 0.706522
211 BTX 0.46281 0.809524
212 DSH 0.462366 0.716049
213 T5A 0.462185 0.809524
214 ADJ 0.462185 0.819277
215 7MC 0.461538 0.809524
216 YLB 0.461538 0.809524
217 YLC 0.461538 0.829268
218 UPA 0.461538 0.871795
219 5X8 0.459184 0.753247
220 SFG 0.459184 0.74026
221 CNA 0.458333 0.92
222 IMO 0.457447 0.890411
223 V3L 0.455446 0.931507
224 IOT 0.453782 0.8
225 KAA 0.453704 0.744444
226 GSU 0.453704 0.770115
227 GJV 0.452632 0.740741
228 6MZ 0.452632 0.891892
229 A2R 0.451923 0.918919
230 COD 0.45082 0.781609
231 CNV FAD 0.450704 0.790698
232 2AM 0.450549 0.878378
233 YLA 0.45 0.809524
234 ITT 0.44898 0.878378
235 COA FLC 0.448819 0.781609
236 FAD NBT 0.447552 0.723404
237 DZD 0.447154 0.85
238 BT5 0.447154 0.8
239 AV2 0.446602 0.905405
240 B1U 0.446429 0.747253
241 YSA 0.446429 0.770115
242 AYB 0.446281 0.8
243 5AD 0.445783 0.736111
244 80F 0.443548 0.809524
245 Y3J 0.44186 0.716216
246 PAX 0.44186 0.819277
247 SAM 0.441176 0.702381
248 A C A C 0.44 0.860759
249 A7D 0.438776 0.766234
250 6AD 0.436893 0.85
251 OVE 0.43617 0.844156
252 A5D 0.435644 0.776316
253 SA8 0.435644 0.698795
254 FAD CNX 0.435374 0.701031
255 MHZ 0.434343 0.689655
256 LQJ 0.433628 0.905405
257 M24 0.433071 0.839506
258 71V 0.43299 0.848101
259 P6G FDA 0.432432 0.764045
260 P33 FDA 0.432432 0.73913
261 A3G 0.431579 0.766234
262 SAH 0.431373 0.734177
263 HFD 0.431373 0.883117
264 SAI 0.431373 0.746835
265 JSQ 0.431373 0.883117
266 6C6 0.431373 0.846154
267 GDP AF3 0.431193 0.829268
268 GEK 0.429907 0.75
269 SMM 0.428571 0.697674
270 U A C C 0.428571 0.871795
271 WSA 0.428571 0.77907
272 0WD 0.427419 0.860759
273 7C5 0.426087 0.78481
274 NO7 0.424528 0.87013
275 7D7 0.423529 0.733333
276 N0B 0.423077 0.809524
277 EEM 0.423077 0.722892
278 NAP 0.423077 0.932432
279 NAJ 0.422764 0.918919
280 FAD NBA 0.422078 0.701031
281 ARU 0.422018 0.804878
282 YLY 0.421875 0.8
283 GGZ 0.420561 0.792683
284 TAP 0.419847 0.896104
285 4YB 0.418803 0.752809
286 GDP ALF 0.418182 0.829268
287 NA7 0.418182 0.894737
288 A6D 0.418182 0.73494
289 ALF GDP 0.418182 0.829268
290 APC G U 0.417323 0.825
291 NA0 0.416667 0.92
292 U A A U 0.416667 0.896104
293 EAD 0.416667 0.839506
294 NEC 0.416667 0.714286
295 NHD 0.416 0.918919
296 DAT 0.415842 0.844156
297 S7M 0.415094 0.702381
298 P1H 0.414815 0.819277
299 J4G 0.414414 0.883117
300 6IA 0.413462 0.804878
301 3AT 0.413462 0.905405
302 8Q2 0.413223 0.744444
303 0UM 0.412844 0.690476
304 KOY 0.411765 0.792208
305 ACK 0.410526 0.849315
306 A3S 0.41 0.776316
307 AAT 0.409524 0.698795
308 AMZ 0.408602 0.853333
309 PGS 0.405941 0.848101
310 2SA 0.40566 0.87013
311 649 0.404959 0.736264
312 CMP 0.40404 0.888889
313 2BA 0.40404 0.902778
314 AVV 0.40367 0.860759
315 NDP 0.403226 0.860759
316 FDA 0.402878 0.781609
317 D5M 0.402062 0.842105
318 N5O 0.402062 0.730769
319 DA 0.402062 0.842105
320 A3T 0.401961 0.786667
321 A U C C 0.40146 0.860759
322 NZQ 0.4 0.85
323 QQX 0.4 0.794872
324 DTP 0.4 0.844156
325 NIA 0.4 0.8125
Ligand no: 2; Ligand: GLC GLC; Similar ligands found: 271
No: Ligand ECFP6 Tc MDL keys Tc
1 M3M 1 1
2 LB2 1 1
3 GLA GLA 1 1
4 MAN GLC 1 1
5 GLC BGC 1 1
6 GLC GLC 1 1
7 NGR 1 1
8 GLA GAL 1 1
9 BGC BGC BGC BGC BGC BGC 0.888889 1
10 GLC BGC BGC BGC BGC BGC BGC 0.888889 1
11 BGC BGC BGC GLC BGC BGC 0.888889 1
12 GLC GLC BGC 0.888889 1
13 GLC GLC GLC GLC 0.888889 1
14 GLC GLC GLC 0.888889 1
15 BMA MAN MAN MAN 0.764706 1
16 MAN MAN MAN 0.685185 1
17 MAN BMA MAN 0.685185 1
18 P3M 0.666667 0.767442
19 GAL GAL SO4 0.660714 0.66
20 BQZ 0.644444 0.909091
21 CGC 0.62963 0.941176
22 GLA GAL GAL 0.618182 1
23 MAN BMA MAN MAN MAN 0.616667 1
24 M5S 0.616667 1
25 2M4 0.612245 1
26 BGC GLC 0.612245 1
27 BMA MAN 0.612245 1
28 GAL MBG 0.607843 0.942857
29 M13 0.607843 0.942857
30 MAN MMA 0.607843 0.942857
31 MDM 0.607843 0.942857
32 BGC BGC BGC BGC BGC BGC BGC BGC 0.603448 1
33 GLC GAL 0.6 1
34 BGC BMA 0.6 1
35 N9S 0.6 1
36 CBI 0.6 1
37 GAL BGC 0.6 1
38 BMA BMA 0.6 1
39 LBT 0.6 1
40 BGC GAL 0.6 1
41 CBK 0.6 1
42 LAT 0.6 1
43 B2G 0.6 1
44 MAB 0.6 1
45 MAL 0.6 1
46 BMA GAL 0.6 1
47 MAN BMA BMA 0.584906 1
48 BMA BMA BMA BMA BMA 0.584906 1
49 MTT 0.584906 1
50 CE6 0.584906 1
51 GAL GAL GAL 0.584906 1
52 BMA BMA BMA BMA BMA BMA 0.584906 1
53 B4G 0.584906 1
54 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.584906 1
55 BGC BGC GLC 0.584906 1
56 MLR 0.584906 1
57 BGC BGC BGC GLC 0.584906 1
58 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.584906 1
59 MAN BMA BMA BMA BMA 0.584906 1
60 GLC BGC BGC BGC 0.584906 1
61 GLA GAL BGC 0.584906 1
62 CTT 0.584906 1
63 MAN MAN BMA BMA BMA BMA 0.584906 1
64 BGC GLC GLC 0.584906 1
65 BGC GLC GLC GLC 0.584906 1
66 BMA MAN BMA 0.584906 1
67 BMA BMA BMA 0.584906 1
68 CEY 0.584906 1
69 DXI 0.584906 1
70 CE8 0.584906 1
71 MAN BMA BMA BMA BMA BMA 0.584906 1
72 GLC GAL GAL 0.584906 1
73 BGC GLC GLC GLC GLC 0.584906 1
74 GLC BGC BGC 0.584906 1
75 CE5 0.584906 1
76 GLA GAL GLC 0.584906 1
77 GLC GLC GLC GLC GLC 0.584906 1
78 GLC BGC GLC 0.584906 1
79 CTR 0.584906 1
80 GLC BGC BGC BGC BGC BGC 0.584906 1
81 BGC BGC BGC 0.584906 1
82 CEX 0.584906 1
83 BGC BGC BGC BGC 0.584906 1
84 CT3 0.584906 1
85 BGC GLC GLC GLC GLC GLC GLC 0.584906 1
86 MT7 0.584906 1
87 GLC BGC BGC BGC BGC 0.584906 1
88 TRE 0.581395 1
89 NAG GAL GAL NAG GAL 0.573529 0.6875
90 BMA MAN MAN MAN MAN 0.5625 1
91 GAL FUC 0.555556 0.941176
92 GLA NAG GAL FUC 0.549296 0.717391
93 LAT GLA 0.54902 1
94 MAN MAN MAN GLC 0.540984 1
95 BGC BGC 0.537037 0.914286
96 U63 0.527273 0.891892
97 GAL A2G 0.525424 0.733333
98 GAL NGA 0.525424 0.733333
99 NAG GAL 0.525424 0.733333
100 GAL NAG 0.525424 0.733333
101 FUC BGC GAL 0.52459 0.970588
102 FUC GLC BGC GAL 0.52459 0.970588
103 MAN MAN MAN MAN 0.52381 1
104 MAN MAN BMA MAN 0.52381 1
105 GLA MBG 0.519231 0.942857
106 DR5 0.518519 0.942857
107 MMA MAN 0.518519 0.942857
108 GLA EGA 0.517857 0.942857
109 DOM 0.509091 0.942857
110 BMA BMA MAN 0.508772 1
111 MAN MAN BMA 0.508772 1
112 AAL GAL 0.508475 0.891892
113 47N 0.508475 0.891892
114 GLA GLA FUC 0.508197 0.970588
115 GLA GAL FUC 0.508197 0.970588
116 FUC GAL GLA 0.508197 0.970588
117 GAL GAL FUC 0.508197 0.970588
118 FUC GLA GLA 0.508197 0.970588
119 BGC BGC BGC BGC BGC 0.5 1
120 MAN BMA NAG 0.5 0.733333
121 BGC BGC BGC BGC BGC BGC BGC 0.5 1
122 NOY BGC 0.5 0.702128
123 MAN MAN MAN MAN MAN MAN MAN 0.5 1
124 GAL NGA A2G 0.5 0.6875
125 GLA GAL NAG 0.5 0.733333
126 BMA BMA MAN GLA GLA 0.492063 1
127 5QP 0.491228 0.885714
128 T6P 0.490909 0.767442
129 RZM 0.490909 0.688889
130 NAG MAN BMA 0.485294 0.733333
131 BGC OXZ 0.482759 0.666667
132 IFM BMA 0.482759 0.711111
133 BMA IFM 0.482759 0.711111
134 IFM BGC 0.482759 0.711111
135 9MR 0.482759 0.744186
136 MAL EDO 0.482759 0.942857
137 GLA MAN ABE 0.477612 0.916667
138 A2G GAL 0.47619 0.653061
139 G2F BGC BGC BGC BGC BGC 0.47619 0.868421
140 MAN MMA MAN 0.47619 0.942857
141 GAL NDG 0.47541 0.733333
142 NLC 0.47541 0.733333
143 MAN MNM 0.474576 0.702128
144 FMO 0.474576 0.868421
145 GLC DMJ 0.474576 0.695652
146 NOJ GLC 0.474576 0.695652
147 MAN MAN MAN BMA MAN 0.471429 1
148 XYT 0.467742 0.767442
149 FRU GAL 0.465517 0.842105
150 BMA FRU 0.465517 0.842105
151 W9T 0.465517 0.842105
152 BMA BMA GLA BMA BMA 0.462687 1
153 BMA BMA BMA GLA BMA 0.462687 1
154 MAN MAN MAN MAN MAN MAN MAN MAN 0.4625 0.846154
155 GLC GLC XYP 0.461538 1
156 MAN G63 0.459016 0.653061
157 GDQ GLC 0.459016 0.666667
158 MAN 7D1 0.45614 0.888889
159 GXL 0.454545 0.848485
160 WOO 0.454545 0.848485
161 ALL 0.454545 0.848485
162 MAN 0.454545 0.848485
163 GLC 0.454545 0.848485
164 GAL 0.454545 0.848485
165 GIV 0.454545 0.848485
166 BGC 0.454545 0.848485
167 BMA 0.454545 0.848485
168 GLA 0.454545 0.848485
169 NAG BMA 0.453125 0.653061
170 BGC GAL NAG GAL 0.452055 0.733333
171 GAL NAG GAL GLC 0.452055 0.733333
172 GLA GAL BGC 5VQ 0.451613 0.891892
173 GAL MGC 0.451613 0.702128
174 GLC GLC GLC BGC 0.447761 1
175 GAL NGA GLA BGC GAL 0.447368 0.733333
176 3MG 0.446809 0.857143
177 LAK 0.446429 1
178 MLB 0.446429 1
179 MAN MAN 0.446429 1
180 GLA BMA 0.446429 1
181 KHO 0.446429 0.888889
182 GAL GAL 0.446429 1
183 MAN BMA 0.446429 1
184 GLA BGC 0.446429 1
185 GLA GLC 0.446429 1
186 BGC GLA 0.446429 1
187 BMA GLA 0.446429 1
188 GAL GLC 0.446429 1
189 FUC GAL NAG GAL FUC 0.443038 0.702128
190 MVP 0.442623 0.733333
191 ABL 0.442623 0.702128
192 MAN DGO 0.440678 0.914286
193 LAT NAG GAL 0.44 0.733333
194 GLC GAL NAG GAL 0.44 0.733333
195 OXZ BGC BGC 0.439394 0.6875
196 G2I 0.439394 0.767442
197 G3I 0.439394 0.767442
198 GYP 0.4375 0.857143
199 MMA 0.4375 0.857143
200 AMG 0.4375 0.857143
201 MBG 0.4375 0.857143
202 GAL BGC BGC XYS 0.43662 0.942857
203 ISX 0.433333 0.761905
204 SOR GLC GLC 0.432836 0.970588
205 GLC GLC GLC GLC BGC 0.431034 1
206 GLC GLC GLC GLC GLC BGC 0.431034 1
207 BMA MAN MAN 0.431034 1
208 GLA GAL GLC NBU 0.430769 0.846154
209 BGC GLA GAL FUC 0.430556 0.970588
210 WZ3 0.428571 0.916667
211 8VZ 0.428571 0.673469
212 GAL AAL GAL AAL GAL AAL 0.426667 0.891892
213 GAL NAG GAL NAG GAL NAG 0.426667 0.673469
214 AAL GAL AAL GLA 0.426667 0.891892
215 AAL GAL AAL GAL 0.426667 0.891892
216 NAG GAL GAL NAG 0.426667 0.6875
217 GLC GLC XYS 0.426471 0.970588
218 MAN IFM 0.42623 0.727273
219 GLC IFM 0.42623 0.727273
220 BGC BGC BGC FRU 0.424242 0.868421
221 OPM MAN MAN 0.422535 0.804878
222 XYS BGC BGC BGC BGC XYS BGC BGC BGC 0.421053 0.942857
223 XYS BGC BGC XYS BGC XYS BGC BGC BGC 0.421053 0.942857
224 BGC BGC BGC XYS GAL 0.421053 0.942857
225 BGC BGC BGC XYS BGC BGC 0.421053 0.942857
226 GLO GLC GLC GLC 0.42029 0.970588
227 LSE 0.42029 0.6875
228 SOR GLC GLC GLC 0.42029 0.970588
229 GLC 7LQ 0.419355 0.885714
230 GAL NGT 0.41791 0.66
231 DMU 0.41791 0.785714
232 LMT 0.41791 0.785714
233 UMQ 0.41791 0.785714
234 NGT GAL 0.41791 0.66
235 LMU 0.41791 0.785714
236 TUR 0.416667 0.842105
237 BTU 0.416667 0.842105
238 GLO GLC GLC 0.416667 0.942857
239 GLC FRU 0.416667 0.842105
240 NGA GLA GAL BGC 0.415584 0.733333
241 GLA MMA ABE 0.414286 0.868421
242 FUC BGC GAL NAG GAL 0.411765 0.717391
243 2M8 0.410714 0.911765
244 BGC RAM BGC GAD 0.409639 0.846154
245 GLC BDF 0.40625 0.916667
246 SIA NAG GAL GAL 0.40625 0.622642
247 NAG GAL BGC 0.405405 0.733333
248 GLA MAN RAM ABE 0.405063 0.891892
249 GAL NAG GAL BGC 0.405063 0.702128
250 RIB 0.404762 0.742857
251 FUB 0.404762 0.742857
252 32O 0.404762 0.742857
253 BDR 0.404762 0.742857
254 AHR 0.404762 0.742857
255 Z6J 0.404762 0.742857
256 NAG MAN BMA MAN NAG GAL 0.404494 0.6875
257 M1P 0.403846 0.697674
258 XGP 0.403846 0.697674
259 GL1 0.403846 0.697674
260 G1P 0.403846 0.697674
261 FUC NDG GAL 0.402778 0.717391
262 GAL NAG MAN 0.402778 0.733333
263 GAL NDG FUC 0.402778 0.717391
264 FUC NAG GAL 0.402778 0.717391
265 NAG NAG BMA MAN 0.402439 0.634615
266 FUC GAL 0.4 0.941176
267 LAG 0.4 0.6
268 GAL NAG GAL 0.4 0.702128
269 6UZ 0.4 0.846154
270 RGG 0.4 0.882353
271 GAL BGC NAG GAL 0.4 0.733333
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3RLF; Ligand: ANP; Similar sites found with APoc: 7
This union binding pocket(no: 1) in the query (biounit: 3rlf.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 5X40 ACP 35.9589
2 5X40 ACP 35.9589
3 2IXE ATP 39.4834
4 2IXE ATP 39.4834
5 3FVQ ATP 44.0111
6 3FVQ ATP 44.0111
7 2PZE ATP 44.5415
Pocket No.: 2; Query (leader) PDB : 3RLF; Ligand: MAL; 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: 3rlf.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3RLF; Ligand: ANP; Similar sites found with APoc: 6
This union binding pocket(no: 3) in the query (biounit: 3rlf.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
1 5X40 ACP 35.9589
2 5X40 ACP 35.9589
3 2IXE ATP 39.4834
4 3FVQ ATP 44.0111
5 3FVQ ATP 44.0111
6 2PZE ATP 44.5415
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