Receptor
PDB id Resolution Class Description Source Keywords
1UP7 2.4 Å EC: 3.2.1.6 STRUCTURE OF THE 6-PHOSPHO-BETA GLUCOSIDASE FROM THERMOTOGA MARITIMA AT 2.4 ANGSTROM RESOLUTION IN THE TETRAGONAL FORM W ITH NAD AND GLUCOSE-6-PHOSPHATE THERMOTOGA MARITIMA HYDROLASE 6-PHOSPHO-BETA-GLUCOSIDASE FAMILY4 HYDROLASE NADEPENDENT
Ref.: NAD+ AND METAL-ION DEPENDENT HYDROLYSIS BY FAMILY 4 GLYCOSIDASES: STRUCTURAL INSIGHT INTO SPECIFICITY F PHOSPHO-BETA-D-GLUCOSIDES J.MOL.BIOL. V. 346 423 2005
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
G6P A:1417;
B:1417;
C:1417;
D:1417;
E:1417;
F:1417;
G:1417;
H:1417;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
260.136 C6 H13 O9 P C([C@...
NAD A:1416;
B:1416;
C:1416;
D:1416;
E:1416;
F:1416;
G:1416;
H:1416;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
663.425 C21 H27 N7 O14 P2 c1cc(...
SO4 A:1418;
C:1418;
Invalid;
Invalid;
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
1UP7 2.4 Å EC: 3.2.1.6 STRUCTURE OF THE 6-PHOSPHO-BETA GLUCOSIDASE FROM THERMOTOGA MARITIMA AT 2.4 ANGSTROM RESOLUTION IN THE TETRAGONAL FORM W ITH NAD AND GLUCOSE-6-PHOSPHATE THERMOTOGA MARITIMA HYDROLASE 6-PHOSPHO-BETA-GLUCOSIDASE FAMILY4 HYDROLASE NADEPENDENT
Ref.: NAD+ AND METAL-ION DEPENDENT HYDROLYSIS BY FAMILY 4 GLYCOSIDASES: STRUCTURAL INSIGHT INTO SPECIFICITY F PHOSPHO-BETA-D-GLUCOSIDES J.MOL.BIOL. V. 346 423 2005
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1UP7 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1UP7 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1UP7 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: G6P; Similar ligands found: 52
No: Ligand ECFP6 Tc MDL keys Tc
1 M6P 1 1
2 BG6 1 1
3 G6P 1 1
4 M6D 1 1
5 BGP 1 1
6 A6P 1 1
7 RP5 0.8 0.902439
8 HSX 0.8 0.902439
9 ABF 0.8 0.902439
10 AHG 0.621622 0.795455
11 GLP 0.590909 0.829787
12 4R1 0.590909 0.829787
13 RF5 0.571429 0.8
14 50A 0.571429 0.8
15 4QY 0.55102 0.75
16 BMX 0.55102 0.75
17 16G 0.55102 0.75
18 GRF 0.547619 0.692308
19 NNG 0.530612 0.75
20 1FT 0.517857 0.847826
21 FDQ 0.511111 0.777778
22 G16 0.5 0.951219
23 PRP 0.5 0.880952
24 T6P 0.470588 0.906977
25 D6G 0.468085 0.951219
26 P3M 0.466667 0.906977
27 GLA 0.461538 0.675
28 GIV 0.461538 0.675
29 WOO 0.461538 0.675
30 GLC 0.461538 0.675
31 ALL 0.461538 0.675
32 BGC 0.461538 0.675
33 GXL 0.461538 0.675
34 GAL 0.461538 0.675
35 BMA 0.461538 0.675
36 MAN 0.461538 0.675
37 GLA BGC 0.45098 0.674419
38 BGC GLA 0.45098 0.674419
39 GLA BMA 0.45098 0.674419
40 LAK 0.45098 0.674419
41 GAL GAL 0.45098 0.674419
42 BMA GLA 0.45098 0.674419
43 MAN BMA 0.45098 0.674419
44 GLA GLC 0.45098 0.674419
45 MLB 0.45098 0.674419
46 N 0.444444 0.777778
47 PPC 0.442308 0.822222
48 GLC GLC GLC 0.433962 0.674419
49 MAN MAN MAN 0.433962 0.674419
50 GLC GLC GLC GLC BGC 0.433962 0.674419
51 GLC GLC GLC GLC GLC BGC 0.433962 0.674419
52 GLC GLC 0.423077 0.707317
Ligand no: 2; Ligand: NAD; Similar ligands found: 220
No: Ligand ECFP6 Tc MDL keys Tc
1 A3D 0.872727 0.986111
2 NAD IBO 0.845455 0.933333
3 NHD 0.821429 0.972222
4 NAP 0.811966 0.986111
5 NAJ PYZ 0.803419 0.910256
6 NFD 0.791304 0.946667
7 NXX 0.765766 0.972603
8 DND 0.765766 0.972603
9 ZID 0.737705 0.986111
10 NAQ 0.729508 0.934211
11 NAE 0.721311 0.959459
12 NA0 0.712 0.972603
13 TAP 0.704 0.921053
14 AMP NAD 0.696 0.945946
15 NDE 0.689922 0.972603
16 NAJ 0.683333 0.972222
17 NDC 0.679389 0.934211
18 NDO 0.674603 0.958904
19 N01 0.656 0.972222
20 CNA 0.642276 0.972603
21 NBP 0.621212 0.922078
22 NAD BBN 0.609929 0.876543
23 8ID 0.609756 0.922078
24 NAD CJ3 0.601399 0.845238
25 ADP MG 0.579439 0.918919
26 A2D 0.576923 0.958333
27 ADP 0.575472 0.931507
28 NGD 0.574803 0.922078
29 BEF ADP 0.574074 0.894737
30 ADP BEF 0.574074 0.894737
31 BA3 0.566038 0.958333
32 NAD NDT 0.565789 0.755319
33 M33 0.564815 0.918919
34 ADP PO3 0.563636 0.957747
35 B4P 0.560748 0.958333
36 AP5 0.560748 0.958333
37 ATP MG 0.558559 0.918919
38 AN2 0.555556 0.918919
39 GAP 0.553571 0.932432
40 OOB 0.551724 0.972222
41 CA0 0.550459 0.932432
42 ATP 0.545455 0.931507
43 ACP 0.545455 0.906667
44 NAD TDB 0.544872 0.70297
45 ADP ALF 0.54386 0.883117
46 ALF ADP 0.54386 0.883117
47 5FA 0.540541 0.931507
48 AQP 0.540541 0.931507
49 APR 0.540541 0.931507
50 AR6 0.540541 0.931507
51 ANP MG 0.53913 0.907895
52 VO4 ADP 0.53913 0.945205
53 ADP VO4 0.53913 0.945205
54 AGS 0.535714 0.883117
55 SAP 0.535714 0.883117
56 AD9 0.535714 0.906667
57 WAQ 0.533333 0.896104
58 ABM 0.53271 0.905405
59 00A 0.529412 0.921053
60 DLL 0.529412 0.972222
61 ANP 0.526316 0.906667
62 NJP 0.526316 0.959459
63 ACQ 0.526316 0.906667
64 OAD 0.525 0.932432
65 AMP MG 0.523364 0.905405
66 ADX 0.522523 0.839506
67 5AL 0.521739 0.945205
68 A1R 0.521008 0.871795
69 9SN 0.520325 0.909091
70 AMP 0.518868 0.930556
71 A 0.518868 0.930556
72 50T 0.517857 0.893333
73 ATF 0.517241 0.894737
74 DAL AMP 0.516949 0.945205
75 3OD 0.516393 0.932432
76 1ZZ 0.516393 0.851852
77 SON 0.513514 0.92
78 PRX 0.513274 0.881579
79 SRP 0.512821 0.92
80 ADP BMA 0.512397 0.932432
81 3UK 0.512397 0.958904
82 MYR AMP 0.512195 0.851852
83 NAJ PZO 0.510949 0.909091
84 NMN 0.509434 0.875
85 AMP DBH 0.507937 0.906667
86 A22 0.504202 0.945205
87 FA5 0.504 0.945946
88 ATP A A A 0.504 0.971831
89 TYR AMP 0.5 0.945946
90 8QN 0.5 0.945205
91 NAX 0.496183 0.886076
92 PR8 0.495935 0.8625
93 PAJ 0.495868 0.873418
94 4AD 0.495868 0.933333
95 AMO 0.495868 0.92
96 ADQ 0.495868 0.932432
97 A12 0.495495 0.894737
98 AP2 0.495495 0.894737
99 ALF ADP 3PG 0.492424 0.873418
100 LA8 ALF 3PG 0.492424 0.873418
101 AHZ 0.492308 0.851852
102 YAP 0.492063 0.933333
103 FYA 0.491935 0.918919
104 AHX 0.491803 0.884615
105 4UU 0.488372 0.933333
106 5SV 0.487603 0.8375
107 TAT 0.487179 0.894737
108 APC 0.486957 0.894737
109 SRA 0.486239 0.881579
110 NAI 0.484848 0.921053
111 6V0 0.484848 0.909091
112 GTA 0.484615 0.898734
113 A A 0.483871 0.958333
114 LAD 0.483871 0.873418
115 AU1 0.482456 0.906667
116 TXE 0.481203 0.921053
117 AF3 ADP 3PG 0.481203 0.873418
118 OMR 0.481203 0.841463
119 LAQ 0.480916 0.851852
120 G3A 0.48062 0.909091
121 TXA 0.48 0.92
122 NB8 0.48 0.884615
123 ME8 0.48 0.851852
124 BIS 0.48 0.871795
125 PTJ 0.48 0.884615
126 139 0.477941 0.886076
127 LPA AMP 0.477273 0.851852
128 AR6 AR6 0.476923 0.958333
129 G5P 0.476923 0.909091
130 AFH 0.476923 0.873418
131 25L 0.47619 0.945205
132 25A 0.47541 0.958333
133 DZD 0.47482 0.897436
134 TXD 0.473684 0.921053
135 4UV 0.472868 0.933333
136 TYM 0.470149 0.945946
137 ADV 0.470085 0.894737
138 RBY 0.470085 0.894737
139 ARG AMP 0.469697 0.841463
140 4TA 0.467626 0.864198
141 48N 0.466165 0.884615
142 XAH 0.465116 0.851852
143 4UW 0.462687 0.897436
144 M24 0.461538 0.886076
145 IOT 0.459854 0.821429
146 T5A 0.456522 0.853659
147 EAD 0.455782 0.886076
148 MAP 0.455285 0.883117
149 BT5 0.453901 0.821429
150 A4P 0.452555 0.833333
151 UP5 0.451852 0.933333
152 PAP 0.445378 0.917808
153 AP0 0.445255 0.884615
154 4TC 0.445255 0.909091
155 YLP 0.444444 0.831325
156 P1H 0.443709 0.864198
157 AOC 0.442478 0.810811
158 Z5A 0.439189 0.833333
159 2A5 0.436975 0.857143
160 G A A A 0.43662 0.909091
161 COD 0.43662 0.802326
162 ADJ 0.435714 0.841463
163 YLC 0.434783 0.851852
164 YLB 0.434783 0.831325
165 U A G G 0.433566 0.921053
166 ATR 0.433333 0.90411
167 7MD 0.432836 0.851852
168 G5A 0.429752 0.790698
169 PO4 PO4 A A A A PO4 0.429688 0.943662
170 TAD 0.42963 0.873418
171 5AS 0.42735 0.770115
172 BTX 0.426573 0.831325
173 YLA 0.425532 0.831325
174 DSZ 0.425197 0.790698
175 NCN 0.424779 0.805556
176 UPA 0.42446 0.921053
177 VMS 0.424 0.8
178 54H 0.424 0.8
179 N0B 0.422819 0.853659
180 6AD 0.422764 0.85
181 AYB 0.422535 0.821429
182 7D3 0.422414 0.844156
183 YLY 0.421769 0.821429
184 TSB 0.420635 0.809524
185 ODP 0.41958 0.922078
186 AV2 0.419355 0.855263
187 FB0 0.419355 0.775281
188 A5A 0.419355 0.819277
189 NNR 0.419048 0.739726
190 A A A 0.418605 0.918919
191 LEU LMS 0.418605 0.793103
192 649 0.417266 0.775281
193 NMN AMP PO4 0.416667 0.933333
194 SSA 0.416 0.790698
195 P5A 0.415385 0.755556
196 LSS 0.414062 0.772727
197 A2R 0.412698 0.918919
198 52H 0.412698 0.790698
199 JB6 0.412214 0.896104
200 5N5 0.411215 0.783784
201 YSA 0.410448 0.811765
202 5CA 0.409449 0.790698
203 53H 0.409449 0.790698
204 ITT 0.408333 0.878378
205 7D4 0.408333 0.844156
206 NA7 0.407692 0.894737
207 5CD 0.407407 0.794521
208 0WD 0.406897 0.909091
209 A3P 0.40678 0.930556
210 AVV 0.40625 0.860759
211 RAB 0.40566 0.808219
212 ADN 0.40566 0.808219
213 XYA 0.40566 0.808219
214 FDA 0.405063 0.823529
215 GSU 0.40458 0.790698
216 7MC 0.404255 0.831325
217 NSS 0.403101 0.811765
218 6FA 0.402516 0.853659
219 NVA LMS 0.4 0.793103
220 PPS 0.4 0.817073
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1UP7; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 1up7.bio1) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1UP7; Ligand: NAD; Similar sites found: 405
This union binding pocket(no: 2) in the query (biounit: 1up7.bio1) has 27 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5CLO NS8 0.004879 0.45176 None
2 1W73 NAP 0.0024 0.41388 0.993378
3 1W8D NAP 0.002787 0.41127 0.993378
4 2WBV SIA 0.03457 0.40688 1.0582
5 4BVA NDP 0.0000892 0.47604 1.19403
6 4BVA T3 0.0001613 0.47543 1.19403
7 1P31 EPU 0.0004482 0.46324 1.19904
8 1P3D UMA 0.001534 0.41315 1.19904
9 4KRI SAH 0.006487 0.40521 1.19904
10 1PL6 NAD 0.0001188 0.47928 1.40449
11 1PL6 572 0.0004352 0.41024 1.40449
12 3ICS ADP 0.0002598 0.49453 1.43885
13 3ICT ADP 0.0003639 0.48744 1.43885
14 3ICR FAD 0.004425 0.41446 1.43885
15 3LXD FAD 0.002376 0.42336 1.44578
16 1WDI CIT 0.02455 0.41104 1.44928
17 2VHW NAI 0.0000102 0.52235 1.59151
18 5E9W SAH 0.006905 0.42545 1.60256
19 2ZWI C5P 0.02674 0.40035 1.60858
20 2F5Z FAD 0.002116 0.43408 1.67866
21 2E4U GLU 0.01717 0.40999 1.67866
22 1ZMD NAI 0.00271 0.40879 1.67866
23 3GFB NAD 0.00005902 0.46189 1.71429
24 2CVZ NDP 0.0008019 0.42287 1.7301
25 3H9E NAD 0.0007613 0.42498 1.7341
26 2Y6Q FAD 0.000616 0.40492 1.75879
27 4GKV NAD 0.00003563 0.4365 1.78571
28 1HDG NAD 0.004309 0.40082 1.80723
29 4E5N NAD 0.000492 0.41297 1.81818
30 2CVQ NDP 0.000006204 0.49177 1.83486
31 2D2I NAP 0.004519 0.40572 1.84211
32 1D1T NAD 0.0003304 0.41411 1.87668
33 1EZ4 NAD 0.00002364 0.48293 1.88679
34 1LDN NAD 0.000006717 0.52151 1.89873
35 2GV8 NDP 0.004428 0.40316 1.91847
36 1SBR VIB 0.02966 0.40588 2
37 3Q3C NAD 0.001134 0.42699 2.00669
38 2VDV SAM 0.01863 0.40087 2.03252
39 1PR9 NAP 0.00426 0.41055 2.04918
40 4ZGS NAD 0.0005193 0.43335 2.07254
41 4XB2 HSE 0.0001147 0.47317 2.08955
42 4XB2 NDP 0.00005869 0.46527 2.08955
43 1TPY SAH 0.003383 0.41402 2.09059
44 1ZQ9 SAM 0.0001859 0.4802 2.10526
45 2GCG NDP 0.0001435 0.44168 2.12121
46 1G51 AMP 0.02601 0.40837 2.15827
47 1BW9 NAD 0.0002199 0.46364 2.24719
48 1BXG NAD 0.0003566 0.43799 2.24719
49 1C1X NAD 0.0001602 0.4513 2.25352
50 2AF6 BRU 0.04012 0.40083 2.32558
51 1VI2 NAD 0.00596 0.40372 2.33333
52 1ZH8 NAP 0.004125 0.40453 2.35294
53 3WCS MAN NAG GAL 0.02549 0.40139 2.3622
54 2CDU ADP 0.0002601 0.47852 2.39808
55 3NJ4 NAD 0.003249 0.46234 2.39808
56 2BRY FAD 0.000494 0.44878 2.39808
57 3NJ4 AFX 0.009335 0.44061 2.39808
58 4KOA NDP 0.0001896 0.48475 2.4024
59 1DXY NAD 0.00007187 0.46471 2.4024
60 1J49 NAD 0.0001073 0.44638 2.4024
61 2EG5 SAH 0.01595 0.40409 2.41935
62 4RDH AMP 0.0003918 0.47533 2.43056
63 4RDI ATP 0.0008719 0.45042 2.43056
64 1NPD NAD 0.003278 0.40843 2.43056
65 5GZ6 NDP 0.003141 0.41866 2.45399
66 5GZ6 7C3 0.004314 0.40655 2.45399
67 3GU3 SAH 0.02337 0.40328 2.46479
68 2I7C AAT 0.0002549 0.40902 2.4735
69 5VKT NAP 0.001629 0.4 2.48619
70 4YMH SAH 0.004321 0.41275 2.5
71 4CJX NAP 0.0006514 0.43326 2.50784
72 2F1K NAP 0.0003636 0.4378 2.50896
73 3DAG FEG 0.0009094 0.42754 2.51397
74 2FK8 SAM 0.00346 0.41687 2.51572
75 2X6T NAP 0.001195 0.40427 2.52101
76 1KYQ NAD 0.000502 0.46559 2.55474
77 5CAE COA 0.0006968 0.43551 2.55591
78 1X7D NAD 0.000004125 0.49693 2.57143
79 1X7D ORN 0.000006287 0.44434 2.57143
80 5AYV KPL 0.002767 0.42064 2.589
81 5AYV NAP 0.001761 0.40952 2.589
82 5KVS NAP 0.004446 0.40309 2.5974
83 3JV7 NAD 0.0001531 0.43536 2.6087
84 1VKO NAD 0.0000285 0.45049 2.63789
85 3G2O SAM 0.003728 0.4224 2.67559
86 1F8F NAD 0.002377 0.41104 2.69542
87 1I0Z NAI 0.00002202 0.46481 2.7027
88 1DSS NAD 0.0007647 0.43051 2.7027
89 1V6A TRE 0.0001166 0.53486 2.71084
90 1B8U NAD 0.000009398 0.52622 2.73556
91 1B8U OAA 0.00006381 0.43885 2.73556
92 3ABI NAD 0.0002429 0.42889 2.73973
93 1WP4 NDP 0.0003654 0.43261 2.76817
94 5K6A NAP 0.002033 0.41969 2.77778
95 3JQ7 NAP 0.001807 0.40662 2.77778
96 3JQA NAP 0.001806 0.40647 2.77778
97 4CME NAP 0.001477 0.40538 2.77778
98 4CLO NAP 0.001986 0.40522 2.77778
99 3JQB NAP 0.002111 0.40402 2.77778
100 3BMO NAP 0.001634 0.40368 2.77778
101 4CM4 NAP 0.00173 0.40288 2.77778
102 4CLR NAP 0.00175 0.40268 2.77778
103 4CMI NAP 0.001741 0.40268 2.77778
104 4CM8 NAP 0.001787 0.40236 2.77778
105 3JQG NAP 0.002403 0.40194 2.77778
106 5JDI NAP 0.001962 0.4009 2.77778
107 5JCJ NAP 0.002046 0.40028 2.77778
108 4CM9 NAP 0.001619 0.40016 2.77778
109 2VT3 ATP 0.00001014 0.44245 2.7907
110 1QPR PHT 0.03225 0.40088 2.8169
111 1LSS NAD 0.0002632 0.46457 2.85714
112 1X87 NAD 0.00006942 0.4801 2.8777
113 4MIG G3F 0.01661 0.40016 2.8777
114 3QX9 ATP 0.01393 0.425 2.89855
115 5O4J PJL 0.0002046 0.41676 2.91971
116 5O4J SAH 0.0001956 0.41304 2.91971
117 5O4J 9KH 0.0001956 0.41304 2.91971
118 3WLE NAD 0.000107 0.41352 2.93255
119 4RQU NAD 0.0001071 0.44524 2.93333
120 2WD7 NAP 0.001559 0.4044 2.98507
121 5BW4 SAM 0.0008312 0.45566 2.99625
122 3MYZ TFX 0.03308 0.43043 3
123 3CBG SAH 0.003553 0.42705 3.01724
124 1I36 NAP 0.001913 0.42105 3.0303
125 1ZBQ NAD 0.0004947 0.40859 3.0581
126 1U1I NAD 0.00001012 0.45501 3.06122
127 5LD5 NAD 0.001573 0.42453 3.07263
128 1ZGA SAH 0.004546 0.43002 3.08123
129 3H8V ATP 0.0001697 0.48196 3.08219
130 1R18 SAH 0.007308 0.40001 3.0837
131 3SQP FAD 0.01372 0.44325 3.11751
132 2NVK NAP 0.006697 0.43988 3.11751
133 4PIV NDP 0.001893 0.42232 3.11751
134 5OFW 9TW 0.001457 0.47746 3.13901
135 1J5P NAD 0.00003747 0.46976 3.16206
136 1R37 NAD 0.00001892 0.50822 3.17003
137 2DFV NAD 0.0001617 0.4458 3.17003
138 1G0N NDP 0.001454 0.43567 3.18021
139 1G0N PHH 0.00184 0.43463 3.18021
140 4UP3 NDP 0.00621 0.40297 3.18471
141 3G89 SAM 0.001649 0.4509 3.21285
142 1SC6 NAD 0.0001566 0.42547 3.21782
143 5KVA SAM 0.0005583 0.44674 3.23741
144 2PXX SAH 0.004408 0.41569 3.25581
145 3BAZ NAP 0.001908 0.41481 3.3033
146 3A27 SAM 0.005367 0.41536 3.30882
147 1R6N 434 0.02573 0.41163 3.31754
148 2PV7 NAD 0.000582 0.42487 3.3557
149 4EIP FAD 0.002877 0.42938 3.35731
150 4EIP K2C 0.003806 0.42603 3.35731
151 1PS9 FAD 0.006079 0.41277 3.35731
152 5KJW 53C 0.02311 0.40893 3.35731
153 5MQ6 NDP 0.004729 0.40491 3.35731
154 1LTH NAD 0.000003498 0.52801 3.44828
155 3AFN NAP 0.006008 0.40444 3.48837
156 4M37 SAH 0.007854 0.40476 3.49854
157 1G55 SAH 0.008758 0.4027 3.49854
158 1RP0 AHZ 0.001331 0.42987 3.52113
159 4E13 NAD 0.0006108 0.44898 3.53357
160 2NXE SAM 0.0004525 0.46306 3.54331
161 2GN3 MMA 0.0108 0.41818 3.57143
162 2GNB MAN 0.01595 0.41539 3.57143
163 2GMM MAN MAN 0.02344 0.4086 3.57143
164 2GNM MAN 0.0311 0.40288 3.57143
165 1UKG MMA 0.03137 0.40182 3.57143
166 5N53 8NB 0.0002948 0.5145 3.58974
167 3OJO NAD 0.00004344 0.48844 3.59712
168 1OFL NGK GCD 0.005349 0.44941 3.59712
169 1SQF SAM 0.001687 0.43769 3.59712
170 5H81 NAP 0.002176 0.42204 3.59897
171 2HJR APR 0.0000125 0.51062 3.65854
172 1BXK NAD 0.001163 0.40864 3.66197
173 3OFK SAH 0.005675 0.40461 3.7037
174 4TQG NDP 0.0002371 0.43298 3.71517
175 5U5G NAP 0.001477 0.40629 3.72881
176 3OA2 NAD 0.00009315 0.44847 3.77358
177 1LLU NAD 0.00009615 0.42299 3.80117
178 2AG8 NAP 0.0001781 0.47179 3.80228
179 2WPF WPF 0.004098 0.45158 3.83693
180 2WPF FAD 0.004754 0.44718 3.83693
181 4TM3 FAD 0.008307 0.42498 3.83693
182 2AE2 NAP 0.01046 0.40189 3.84615
183 3V1Y NAD 0.0007852 0.42434 3.85757
184 2Q0L NAP 0.005811 0.42105 3.85852
185 4OBW SAM 0.003246 0.42507 3.89105
186 1GEG NAD 0.000843 0.40958 3.90625
187 3WMX NAD 0.0004467 0.43388 3.91061
188 3WMX THR 0.02697 0.40809 3.91061
189 2YVF NAD 0.00127 0.45723 3.92157
190 2YVF FAD 0.001349 0.45534 3.92157
191 5TUK FAD 0.001161 0.41349 3.92157
192 2WSB NAD 0.004473 0.4174 3.93701
193 3NGL NAP 0.001949 0.4275 3.98551
194 4JJF FE9 0.0004192 0.42982 4.06977
195 4JJF N2I 0.0005016 0.41706 4.06977
196 1V59 NAD 0.0001141 0.51184 4.07674
197 1GQ2 NAP 0.0002013 0.43626 4.07674
198 1MO9 KPC 0.007149 0.43355 4.07674
199 1MO9 FAD 0.008908 0.42867 4.07674
200 3V1U NAD 0.004278 0.40094 4.07674
201 1GR0 NAD 0.00006954 0.43038 4.08719
202 3WV8 ATP 0.0002676 0.46862 4.12844
203 4L8V NAP 0.00059 0.44135 4.1543
204 1SAY PYR 0.0001731 0.41762 4.15512
205 3CIF G3H 0.001165 0.43612 4.17827
206 3CIF NAD 0.0007942 0.43466 4.17827
207 1ZEM NAD 0.0001347 0.45414 4.19847
208 1HYH NAD 0.0000006322 0.50949 4.20712
209 4OOE NDP 0.001208 0.41763 4.20792
210 2G5C NAD 0.00003838 0.45532 4.27046
211 1MV8 NAD 0.00006456 0.46642 4.31655
212 1MUU NAD 0.0001812 0.45522 4.31655
213 3NT6 FAD 0.006706 0.408 4.31655
214 3S5W NAP 0.01579 0.4043 4.31655
215 4K28 NAD 0.0002178 0.45206 4.46097
216 3B1F NAD 0.0004542 0.45048 4.48276
217 3FZG SAM 0.001489 0.44848 4.5
218 2Q1S NAI 0.0004239 0.46364 4.50928
219 1UAY ADN 0.003579 0.43495 4.54545
220 3VYW SAM 0.005757 0.40743 4.54545
221 1RYI FAD 0.002442 0.42946 4.55635
222 3NTD FAD 0.002916 0.42308 4.55635
223 4UCI SAM 0.002925 0.42345 4.57831
224 3DXY SAM 0.002535 0.44658 4.58716
225 1Q0S SAH 0.00526 0.40015 4.6332
226 1I9G SAM 0.001635 0.43076 4.64286
227 1H2B NAJ 0.00004991 0.43847 4.73538
228 5DNK SAH 0.0008905 0.47394 4.79616
229 1DJN ADP 0.0004751 0.44586 4.79616
230 2BH9 NAP 0.006045 0.42026 4.79616
231 3IHG FAD 0.0007709 0.4146 4.79616
232 1V8B NAD 0.0001842 0.40514 4.79616
233 3FUU ADN 0.002672 0.42516 4.79705
234 1LVL NAD 0.0007229 0.44587 4.80349
235 4DMG SAM 0.019 0.40402 4.83461
236 1O94 ADP 0.0005077 0.44104 4.92424
237 5DN9 NAD 0.0003952 0.40874 4.94506
238 1JXN MFU 0.03674 0.40164 4.95868
239 5JE8 NAD 0.000041 0.48071 4.96689
240 3GDH SAH 0.004987 0.40108 4.97925
241 1X14 NAD 0.00007983 0.50177 4.98753
242 1BZL FAD 0.003785 0.45224 5.03597
243 1Y8Q ATP 0.0009781 0.42958 5.03597
244 2BGM NAJ 0.0009172 0.42903 5.03597
245 2B9W FAD 0.01517 0.40628 5.03597
246 1XTP SAI 0.008422 0.40665 5.11811
247 1WDK NAD 0.0001875 0.46241 5.12821
248 1CER NAD 0.002333 0.40633 5.13595
249 1ELI PYC 0.006434 0.40875 5.14139
250 1F8G NAD 0.0006801 0.44315 5.20833
251 1L7E NAI 0.001348 0.42397 5.20833
252 1L3I SAH 0.002036 0.40875 5.20833
253 4USR FAD 0.001955 0.42438 5.26316
254 1O0S NAI 0.000107 0.47239 5.27578
255 4C4A SAH 0.002933 0.4234 5.27578
256 3PT9 SAH 0.01106 0.40137 5.27578
257 4TXI FAD 0.0008121 0.40128 5.27578
258 3EGI ADP 0.0006998 0.49116 5.33981
259 1NFQ NAI 0.004578 0.40804 5.38462
260 3H2B SAH 0.004251 0.41638 5.41872
261 2GLX NDP 0.0008464 0.43211 5.42169
262 3GRU AMP 0.001643 0.41014 5.42373
263 4YCA NDP 0.002718 0.4045 5.44218
264 1GV0 NAD 0.00001546 0.46926 5.48387
265 3VPH NAD 0.00001219 0.45672 5.48387
266 3VPH OXM 0.00001096 0.45143 5.48387
267 1FEC FAD 0.002996 0.43047 5.51559
268 1JG3 ADN 0.001481 0.4402 5.53191
269 1LUA NAP 0.00448 0.41208 5.57491
270 1EBF NAD 0.0005381 0.43258 5.58659
271 1CF2 NAP 0.002803 0.40975 5.63798
272 2YX1 SFG 0.01094 0.4119 5.65476
273 5TPX 7H7 0.03498 0.40264 5.69106
274 2XYQ SAH 0.001269 0.44318 5.7377
275 2OOR NAD 0.0007821 0.44062 5.74713
276 1W0O SIA 0.01557 0.42405 5.7554
277 4D3F NAP 0.0007175 0.44218 5.80645
278 2DC1 NAD 0.0003647 0.43199 5.9322
279 1R6D NAD 0.00445 0.42807 5.93472
280 1R6D DAU 0.004864 0.42562 5.93472
281 1O6Z NAD 0.000005084 0.52148 5.94059
282 5AHO TLA 0.001525 0.46804 5.95238
283 1XCL SAH 0.0003944 0.41574 5.95745
284 2GDZ NAD 0.001333 0.42709 5.99251
285 2IZ1 ATR 0.0008732 0.4874 5.9952
286 9LDT NAD 0.000004026 0.48284 6.0241
287 9LDB NAD 0.000005056 0.47995 6.0241
288 5N2I NAP 0.005803 0.40728 6.03448
289 4W6Z 8ID 0.0001875 0.47012 6.05187
290 1JQ3 AAT 0.0002022 0.41779 6.08108
291 4USQ FAD 0.002841 0.41897 6.09418
292 2DT5 NAD 0.0000157 0.47622 6.16114
293 2HK9 ATR 0.0006159 0.48189 6.18182
294 2HK9 NAP 0.001439 0.41479 6.18182
295 2PWY SAH 0.003205 0.41185 6.20155
296 4UZI IMD 0.01696 0.42075 6.23501
297 3HRD NIO 0.03598 0.41349 6.23501
298 5ITV NAI 0.0004639 0.4148 6.27451
299 4MDH NAD 0.00001445 0.4849 6.28743
300 5MDH NAD 0.00002302 0.47745 6.30631
301 1PZG A3D 0.00001784 0.43304 6.34441
302 1UXG NAD 0.00002083 0.42576 6.47249
303 1T26 NAI 0.000007841 0.42397 6.52174
304 2A92 NAI 0.000002511 0.48663 6.54206
305 2B4R AES 0.001088 0.40405 6.66667
306 3UCL FAD 0.003875 0.43787 6.71463
307 3UCL CYH 0.003875 0.43787 6.71463
308 3UCL NAP 0.004496 0.43692 6.71463
309 2JJQ SAH 0.004065 0.43232 6.71463
310 4AZT SAM 0.009852 0.40362 6.71463
311 5D4V SAH 0.0001161 0.47523 6.71642
312 1NVM NAD 0.0001365 0.43095 6.73077
313 4QTU SAM 0.003193 0.42179 6.73077
314 4PLG NAI 0.000004058 0.45131 6.88623
315 2DBZ NAP 0.001843 0.41999 6.88623
316 1A5Z NAD 0.00004255 0.49345 6.89655
317 2VYN NAD 0.0008266 0.41307 6.94864
318 1GAD NAD 0.002483 0.41184 6.9697
319 1SOW NAD 0.000002728 0.48368 7.0122
320 1E6E FAD 0.0002062 0.40108 7.03125
321 1P1C SAH 0.0004181 0.44813 7.03518
322 3C3Y SAH 0.006311 0.40891 7.173
323 3GD4 NAD 0.002744 0.41462 7.19424
324 1GZ6 NAI 0.0005142 0.41232 7.21003
325 4MP8 NAD 0.00002906 0.4261 7.37463
326 2DPM SAM 0.006654 0.40172 7.39437
327 1VM6 NAD 0.00004273 0.48 7.45614
328 3KB6 NAD 0.00202 0.40509 7.48503
329 1CDO NAD 0.0002346 0.44497 7.48663
330 5L95 AMP 0.00128 0.43906 7.5
331 3O03 NAP 0.001331 0.41593 7.56014
332 2YGM GLA NAG GAL FUC 0.01429 0.41816 7.62712
333 3RF4 FUN 0.03616 0.40131 7.75862
334 1KOL NAD 0.0001801 0.40887 7.78894
335 2IDV M7G 0.01197 0.43762 7.9096
336 2YY7 NAD 0.0001772 0.42764 8.01282
337 5UAV NDP 0.0004249 0.40607 8.07453
338 5UAV TFB 0.0004577 0.40142 8.07453
339 2O4C NAD 0.0001869 0.46303 8.1579
340 3EGV SAH 0.000765 0.4573 8.16327
341 3MB5 SAM 0.002633 0.41535 8.23529
342 2YVJ NAI 0.0006518 0.45603 8.25688
343 5N18 8HZ 0.009534 0.43302 8.25688
344 3JUT GTQ 0.0187 0.41754 8.46154
345 1LDM NAD 0.00001244 0.47323 8.51064
346 4NBW NAD 0.001151 0.41389 8.56031
347 1IY8 NAD 0.0009055 0.40443 8.61423
348 1NV8 MEQ 0.001826 0.40621 8.80282
349 1NV8 SAM 0.001987 0.4005 8.80282
350 1P77 ATR 0.001068 0.48157 8.82353
351 3NUG NAD 0.0006588 0.44089 8.90688
352 3GEG NAD 0.001248 0.413 8.90688
353 2D5A COA 0.005162 0.40335 9.02778
354 1L1E SAH 0.003119 0.41879 9.05923
355 1HKU NAD 0.0001372 0.43196 9.21788
356 3LAD FAD 0.004898 0.41769 9.35252
357 2PZM NAD 0.006813 0.41255 9.39394
358 2PZM UDP 0.006813 0.41255 9.39394
359 3SSO SAH 0.002141 0.42576 9.59233
360 4NBU NAI 0.0003395 0.41887 9.6
361 1OMO NAD 0.00001811 0.49928 9.62733
362 2PT9 S4M 0.0007737 0.43031 9.65732
363 3L9W GSH 0.001111 0.40947 9.68523
364 3L9W AMP 0.001141 0.40041 9.68523
365 2NU8 COA 0.0003223 0.44005 9.72222
366 1OBB NAD 0.00000003194 0.61006 9.83213
367 1HYE NAP 0.0006039 0.44158 9.90415
368 5KKA 6V0 0.00001006 0.46386 9.9359
369 4CQM NAP 0.001437 0.40234 9.96169
370 1N2X SAM 0.001318 0.42769 9.96678
371 4JK3 NAD 0.00004441 0.4731 10.0386
372 2HNK SAH 0.002157 0.42563 10.0418
373 2O07 MTA 0.0004472 0.42913 10.1974
374 2O07 SPD 0.0004975 0.41788 10.1974
375 2BOS GLA GAL GLC 0.003896 0.4566 10.2941
376 2BOS GLA GAL GLC NBU 0.003987 0.45593 10.2941
377 5THQ NDP 0.001795 0.42187 10.2941
378 1JNR FAD 0.009851 0.42452 10.6667
379 1DRV A3D 0.001243 0.4322 10.989
380 1KPG SAH 0.00367 0.41254 11.1498
381 4GLL NAD 0.003336 0.41364 11.276
382 4V3C C 0.01178 0.40678 11.3402
383 3X0D SAH 0.005827 0.41041 11.7506
384 4D79 ATP 0.0008587 0.45071 11.9565
385 1NYT NAP 0.003218 0.40584 12.1771
386 3LCC SAH 0.005394 0.41882 13.1915
387 5LOG SAH 0.001965 0.43097 13.3047
388 2EJU SAH 0.004772 0.41763 13.4921
389 5E8J SAH 0.009823 0.41412 13.6364
390 3HVJ 705 0.0004144 0.45714 14.0271
391 3Q9N COA 0.002773 0.40994 14.1844
392 4FK7 P34 0.04352 0.40443 14.4105
393 3QV1 NAD 0.002978 0.40717 14.6341
394 1C3V NDP 0.00004352 0.44896 14.6939
395 2HMT NAI 0.0001652 0.46883 15.9722
396 3DUW SAH 0.004712 0.41443 19.7309
397 3AD8 NAD 0.001024 0.43715 21.2121
398 1GUZ NAD 0.000009781 0.51125 22.2581
399 1EJ0 SAM 0.001058 0.44668 23.8889
400 5MGJ 7MX 0.00942 0.42338 27.619
401 2FKA BEF 0.0005653 0.49905 31.7829
402 4II2 ATP 0.001653 0.43056 32.5301
403 3IWD M2T 0.01979 0.4152 35.4839
404 1VJT NAD 0.00000002149 0.6466 44.3645
405 1U8X NAD 0.0000001369 0.56914 49.1607
Pocket No.: 3; Query (leader) PDB : 1UP7; Ligand: G6P; Similar sites found: 3
This union binding pocket(no: 3) in the query (biounit: 1up7.bio1) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2FAH MLA 0.01546 0.40222 2.15827
2 3ZVS MLI 0.002737 0.42777 5.625
3 1U8X G6P 0.0000000003636 0.80899 49.1607
Pocket No.: 4; Query (leader) PDB : 1UP7; Ligand: G6P; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 1up7.bio1) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 1UP7; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 1up7.bio1) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 1UP7; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 1up7.bio1) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 1UP7; Ligand: G6P; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 1up7.bio1) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 1UP7; Ligand: G6P; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 1up7.bio1) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 1UP7; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 1up7.bio2) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 10; Query (leader) PDB : 1UP7; Ligand: G6P; Similar sites found: 1
This union binding pocket(no: 10) in the query (biounit: 1up7.bio2) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3B8I OXL 0.02497 0.41278 2.43902
Pocket No.: 11; Query (leader) PDB : 1UP7; Ligand: G6P; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 11) in the query (biounit: 1up7.bio2) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 12; Query (leader) PDB : 1UP7; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 12) in the query (biounit: 1up7.bio2) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 13; Query (leader) PDB : 1UP7; Ligand: NAD; Similar sites found: 24
This union binding pocket(no: 13) in the query (biounit: 1up7.bio2) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4AZW SAM 0.008935 0.40083 1.43885
2 5E1M SAH 0.007054 0.40215 2.48963
3 1YS4 NAP 0.004639 0.40673 2.54237
4 4J1Q NDP 0.005636 0.40184 2.8777
5 5X62 SAH 0.01293 0.40009 3.20197
6 1YTM OXD 0.02132 0.41533 3.35731
7 1Q8Q MAN MMA 0.03655 0.40007 3.57143
8 2P0D I3P 0.002094 0.40035 4.65116
9 4IRP UDP 0.02685 0.40842 4.78088
10 4XUB 43D 0.021 0.40421 5.12821
11 3IP5 ALA 0.03409 0.40289 5.33708
12 1I1N SAH 0.006071 0.40053 5.75221
13 4UYF 73B 0.01546 0.41779 5.84416
14 1AE1 NAP 0.008029 0.4019 6.95971
15 3P2E SAH 0.007359 0.40137 7.11111
16 2EUG URA 0.007456 0.4205 8.29694
17 5SXS NIZ 0.006771 0.43907 8.63309
18 4B2D SER 0.02166 0.41609 9.59233
19 5DW1 5GD 0.01613 0.41961 10.6195
20 4UYG 73B 0.02818 0.40567 11.465
21 1DIG NAP 0.0005777 0.40316 12.4183
22 1KPH SAH 0.002994 0.4001 13.5889
23 3BU1 HSM 0.02184 0.40892 16.2162
24 3AD8 FAD 0.02719 0.40291 21.2121
Pocket No.: 14; Query (leader) PDB : 1UP7; Ligand: G6P; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 14) in the query (biounit: 1up7.bio2) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 15; Query (leader) PDB : 1UP7; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 15) in the query (biounit: 1up7.bio2) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 16; Query (leader) PDB : 1UP7; Ligand: G6P; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 16) in the query (biounit: 1up7.bio2) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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