-->
Receptor
PDB id Resolution Class Description Source Keywords
1UGY 2.4 Å NON-ENZYME: BINDING CRYSTAL STRUCTURE OF JACALIN- MELLIBIOSE (GAL-ALPHA(1-6)- GLC) COMPLEX ARTOCARPUS INTEGER ALL BETA SHEETS PROTEIN BETA-PRISM I FOLD GAL SPECIFIC SUGAR BINDING PROTEIN
Ref.: STRUCTURAL BASIS OF THE CARBOHYDRATE SPECIFICITIES OF JACALIN: AN X-RAY AND MODELING STUDY J.MOL.BIOL. V. 332 217 2003
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GLA BGC E:200;
G:200;
Valid;
Valid;
none;
none;
Ka = 5310 M^-1
342.297 n/a O(CC1...
GLA GLC A:200;
C:200;
Valid;
Valid;
none;
none;
Ka = 5310 M^-1
342.297 n/a O(CC1...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1UGY 2.4 Å NON-ENZYME: BINDING CRYSTAL STRUCTURE OF JACALIN- MELLIBIOSE (GAL-ALPHA(1-6)- GLC) COMPLEX ARTOCARPUS INTEGER ALL BETA SHEETS PROTEIN BETA-PRISM I FOLD GAL SPECIFIC SUGAR BINDING PROTEIN
Ref.: STRUCTURAL BASIS OF THE CARBOHYDRATE SPECIFICITIES OF JACALIN: AN X-RAY AND MODELING STUDY J.MOL.BIOL. V. 332 217 2003
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 510 families.
1 1UGY Ka = 5310 M^-1 GLA BGC n/a n/a
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 391 families.
1 1UGY Ka = 5310 M^-1 GLA BGC n/a n/a
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 298 families.
1 1UGY Ka = 5310 M^-1 GLA BGC n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GLA BGC; Similar ligands found: 178
No: Ligand ECFP6 Tc MDL keys Tc
1 BGC GLA 1 1
2 GAL GLC 1 1
3 GLA BGC 1 1
4 BGC GLC 1 1
5 GLA GLC 1 1
6 LAK 1 1
7 GAL GAL 1 1
8 GLC BGC 1 1
9 MLB 1 1
10 MAN BMA 1 1
11 MAN MAN 1 1
12 BMA GLA 1 1
13 BMA MAN 1 1
14 GLC GLC 1 1
15 GLA BMA 1 1
16 BMA MAN MAN 0.953488 1
17 GLC GLC GLC GLC GLC BGC 0.953488 1
18 MAN MAN MAN 0.953488 1
19 GLC GLC GLC 0.953488 1
20 GLC GLC GLC GLC BGC 0.953488 1
21 AHR AHR 0.75 0.857143
22 FUB AHR 0.75 0.857143
23 MAN MAN MAN MAN 0.732143 1
24 MAN MAN BMA MAN 0.732143 1
25 AHR AHR AHR AHR AHR AHR 0.702128 0.857143
26 FUB AHR AHR 0.702128 0.857143
27 MAN BMA MAN 0.672727 1
28 MAN MMA 0.66 0.942857
29 GLC GLC GLC BGC 0.633333 1
30 M5S 0.606557 1
31 MAN BMA MAN MAN MAN 0.606557 1
32 MAN MAN MAN BMA MAN 0.575758 1
33 BMA BMA GLA BMA BMA 0.546875 1
34 MAN MMA MAN 0.540984 0.942857
35 MAN MAN MAN MAN MAN MAN MAN 0.535211 1
36 RAF 0.515625 0.891892
37 GIV 0.511628 0.848485
38 GLA 0.511628 0.848485
39 WOO 0.511628 0.848485
40 MAN 0.511628 0.848485
41 GAL 0.511628 0.848485
42 GLC 0.511628 0.848485
43 BGC 0.511628 0.848485
44 GXL 0.511628 0.848485
45 BMA 0.511628 0.848485
46 ALL 0.511628 0.848485
47 STW 0.507692 0.891892
48 MAN MAN MAN BMA MAN MAN MAN 0.5 0.942857
49 BMA MAN MAN MAN MAN 0.485294 1
50 NGB 0.485294 0.622642
51 4CQ 0.483871 0.970588
52 WZ2 0.477612 0.868421
53 LBT 0.472727 1
54 N9S 0.472727 1
55 CBI 0.472727 1
56 MAB 0.472727 1
57 LAT 0.472727 1
58 CBK 0.472727 1
59 B2G 0.472727 1
60 BGC BMA 0.472727 1
61 GLC GAL 0.472727 1
62 GLA GLA 0.472727 1
63 BMA GAL 0.472727 1
64 GLA GAL 0.472727 1
65 MAL 0.472727 1
66 GAL BGC 0.472727 1
67 BGC GAL 0.472727 1
68 NAG MAN MAN 0.472222 0.733333
69 RGG 0.471698 0.882353
70 SUC GLA 0.471429 0.891892
71 DMJ MAN 0.466667 0.695652
72 NOJ BGC 0.466667 0.695652
73 WZ3 0.463768 0.916667
74 DEG 0.462963 0.769231
75 IFM MAN 0.459016 0.711111
76 EMZ 0.458333 0.783784
77 M6P 0.45098 0.674419
78 G6P 0.45098 0.674419
79 BG6 0.45098 0.674419
80 M6D 0.45098 0.674419
81 A6P 0.45098 0.674419
82 BGP 0.45098 0.674419
83 AHR AHR AHR 0.45 0.805556
84 EBG 0.446429 0.837838
85 M3M 0.446429 1
86 LB2 0.446429 1
87 NGR 0.446429 1
88 EBQ 0.446429 0.789474
89 MAN GLC 0.446429 1
90 MT7 0.440678 1
91 MAN BMA BMA BMA BMA BMA 0.440678 1
92 DXI 0.440678 1
93 GLC GAL GAL 0.440678 1
94 BGC BGC BGC BGC 0.440678 1
95 GLC BGC BGC BGC BGC BGC 0.440678 1
96 GLC BGC GLC 0.440678 1
97 CEX 0.440678 1
98 GLC BGC BGC BGC BGC 0.440678 1
99 BGC GLC GLC GLC GLC GLC GLC 0.440678 1
100 MLR 0.440678 1
101 BGC BGC BGC BGC BGC 0.440678 1
102 CE5 0.440678 1
103 MAN BMA BMA BMA BMA 0.440678 1
104 BMA BMA BMA BMA BMA 0.440678 1
105 MTT 0.440678 1
106 MAN MAN BMA BMA BMA BMA 0.440678 1
107 GLC GLC GLC GLC GLC 0.440678 1
108 BGC GLC GLC 0.440678 1
109 BMA MAN BMA 0.440678 1
110 BGC GLC GLC GLC 0.440678 1
111 GLA GAL GLC 0.440678 1
112 CT3 0.440678 1
113 BGC BGC BGC 0.440678 1
114 BGC BGC GLC 0.440678 1
115 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.440678 1
116 CTR 0.440678 1
117 CEY 0.440678 1
118 GLC BGC BGC 0.440678 1
119 GLA GAL BGC 0.440678 1
120 BMA BMA BMA BMA BMA BMA 0.440678 1
121 GLC GLC BGC 0.440678 1
122 CTT 0.440678 1
123 BGC BGC BGC BGC BGC BGC 0.440678 1
124 BGC BGC BGC GLC 0.440678 1
125 MAN BMA BMA 0.440678 1
126 B4G 0.440678 1
127 GAL GAL GAL 0.440678 1
128 BGC GLC GLC GLC GLC 0.440678 1
129 CE8 0.440678 1
130 BMA BMA BMA 0.440678 1
131 GLC BGC BGC BGC 0.440678 1
132 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.440678 1
133 CE6 0.440678 1
134 ACY 1GN GAL 1GN BGC ACY GAL BGC 0.439024 0.6875
135 1GN ACY GAL ACY 1GN BGC GAL BGC 0.439024 0.6875
136 JZR 0.438596 0.714286
137 BHG 0.438596 0.714286
138 GLC HEX 0.438596 0.714286
139 TRE 0.4375 1
140 BMA Z4Y NAG 0.435897 0.717391
141 B7G 0.431034 0.738095
142 KGM 0.431034 0.738095
143 2M4 0.428571 1
144 MBG 0.428571 0.857143
145 MMA 0.428571 0.857143
146 GYP 0.428571 0.857143
147 AMG 0.428571 0.857143
148 GAL GAL SO4 0.424242 0.66
149 BOG 0.423729 0.738095
150 BNG 0.423729 0.738095
151 HSJ 0.423729 0.738095
152 M1P 0.423077 0.697674
153 XGP 0.423077 0.697674
154 G1P 0.423077 0.697674
155 GL1 0.423077 0.697674
156 BGC BGC XYS BGC 0.418919 0.942857
157 GAL FUC 0.416667 0.941176
158 SER MAN 0.416667 0.72093
159 XYT 0.415385 0.767442
160 BQZ 0.415094 0.909091
161 6SA 0.414894 0.733333
162 GAL BGC NAG GAL 0.413333 0.733333
163 GAL BGC BGC XYS 0.410959 0.942857
164 BGC BGC BGC GLC BGC BGC 0.409836 1
165 GLC BGC BGC BGC BGC BGC BGC 0.409836 1
166 GLA EGA 0.409836 0.942857
167 DGD 0.409639 0.733333
168 BMA NAG MAN MAN MAN MAN MAN MAN MAN 0.409091 0.733333
169 NAG NAG BMA MAN MAN 0.406977 0.6875
170 T6P 0.40678 0.767442
171 GLA GAL GAL 0.40625 1
172 IAB 0.404494 0.733333
173 MAN MAN BMA 0.403226 1
174 BMA BMA MAN 0.403226 1
175 GLC BGC BGC XYS BGC XYS XYS 0.402597 0.942857
176 BGC BGC BGC XYS BGC XYS XYS 0.402597 0.942857
177 BGC BGC XYS BGC XYS BGC XYS 0.402597 0.942857
178 BMA MAN MAN MAN 0.4 1
Ligand no: 2; Ligand: GLA GLC; Similar ligands found: 178
No: Ligand ECFP6 Tc MDL keys Tc
1 BGC GLA 1 1
2 GAL GLC 1 1
3 GLA BGC 1 1
4 BGC GLC 1 1
5 GLA GLC 1 1
6 LAK 1 1
7 GAL GAL 1 1
8 GLC BGC 1 1
9 MLB 1 1
10 MAN BMA 1 1
11 MAN MAN 1 1
12 BMA GLA 1 1
13 BMA MAN 1 1
14 GLC GLC 1 1
15 GLA BMA 1 1
16 BMA MAN MAN 0.953488 1
17 GLC GLC GLC GLC GLC BGC 0.953488 1
18 MAN MAN MAN 0.953488 1
19 GLC GLC GLC 0.953488 1
20 GLC GLC GLC GLC BGC 0.953488 1
21 AHR AHR 0.75 0.857143
22 FUB AHR 0.75 0.857143
23 MAN MAN MAN MAN 0.732143 1
24 MAN MAN BMA MAN 0.732143 1
25 AHR AHR AHR AHR AHR AHR 0.702128 0.857143
26 FUB AHR AHR 0.702128 0.857143
27 MAN BMA MAN 0.672727 1
28 MAN MMA 0.66 0.942857
29 GLC GLC GLC BGC 0.633333 1
30 M5S 0.606557 1
31 MAN BMA MAN MAN MAN 0.606557 1
32 MAN MAN MAN BMA MAN 0.575758 1
33 BMA BMA GLA BMA BMA 0.546875 1
34 MAN MMA MAN 0.540984 0.942857
35 MAN MAN MAN MAN MAN MAN MAN 0.535211 1
36 RAF 0.515625 0.891892
37 GIV 0.511628 0.848485
38 GLA 0.511628 0.848485
39 WOO 0.511628 0.848485
40 MAN 0.511628 0.848485
41 GAL 0.511628 0.848485
42 GLC 0.511628 0.848485
43 BGC 0.511628 0.848485
44 GXL 0.511628 0.848485
45 BMA 0.511628 0.848485
46 ALL 0.511628 0.848485
47 STW 0.507692 0.891892
48 MAN MAN MAN BMA MAN MAN MAN 0.5 0.942857
49 BMA MAN MAN MAN MAN 0.485294 1
50 NGB 0.485294 0.622642
51 4CQ 0.483871 0.970588
52 WZ2 0.477612 0.868421
53 LBT 0.472727 1
54 N9S 0.472727 1
55 CBI 0.472727 1
56 MAB 0.472727 1
57 LAT 0.472727 1
58 CBK 0.472727 1
59 B2G 0.472727 1
60 BGC BMA 0.472727 1
61 GLC GAL 0.472727 1
62 GLA GLA 0.472727 1
63 BMA GAL 0.472727 1
64 GLA GAL 0.472727 1
65 MAL 0.472727 1
66 GAL BGC 0.472727 1
67 BGC GAL 0.472727 1
68 NAG MAN MAN 0.472222 0.733333
69 RGG 0.471698 0.882353
70 SUC GLA 0.471429 0.891892
71 DMJ MAN 0.466667 0.695652
72 NOJ BGC 0.466667 0.695652
73 WZ3 0.463768 0.916667
74 DEG 0.462963 0.769231
75 IFM MAN 0.459016 0.711111
76 EMZ 0.458333 0.783784
77 M6P 0.45098 0.674419
78 G6P 0.45098 0.674419
79 BG6 0.45098 0.674419
80 M6D 0.45098 0.674419
81 A6P 0.45098 0.674419
82 BGP 0.45098 0.674419
83 AHR AHR AHR 0.45 0.805556
84 EBG 0.446429 0.837838
85 M3M 0.446429 1
86 LB2 0.446429 1
87 NGR 0.446429 1
88 EBQ 0.446429 0.789474
89 MAN GLC 0.446429 1
90 MT7 0.440678 1
91 MAN BMA BMA BMA BMA BMA 0.440678 1
92 DXI 0.440678 1
93 GLC GAL GAL 0.440678 1
94 BGC BGC BGC BGC 0.440678 1
95 GLC BGC BGC BGC BGC BGC 0.440678 1
96 GLC BGC GLC 0.440678 1
97 CEX 0.440678 1
98 GLC BGC BGC BGC BGC 0.440678 1
99 BGC GLC GLC GLC GLC GLC GLC 0.440678 1
100 MLR 0.440678 1
101 BGC BGC BGC BGC BGC 0.440678 1
102 CE5 0.440678 1
103 MAN BMA BMA BMA BMA 0.440678 1
104 BMA BMA BMA BMA BMA 0.440678 1
105 MTT 0.440678 1
106 MAN MAN BMA BMA BMA BMA 0.440678 1
107 GLC GLC GLC GLC GLC 0.440678 1
108 BGC GLC GLC 0.440678 1
109 BMA MAN BMA 0.440678 1
110 BGC GLC GLC GLC 0.440678 1
111 GLA GAL GLC 0.440678 1
112 CT3 0.440678 1
113 BGC BGC BGC 0.440678 1
114 BGC BGC GLC 0.440678 1
115 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.440678 1
116 CTR 0.440678 1
117 CEY 0.440678 1
118 GLC BGC BGC 0.440678 1
119 GLA GAL BGC 0.440678 1
120 BMA BMA BMA BMA BMA BMA 0.440678 1
121 GLC GLC BGC 0.440678 1
122 CTT 0.440678 1
123 BGC BGC BGC BGC BGC BGC 0.440678 1
124 BGC BGC BGC GLC 0.440678 1
125 MAN BMA BMA 0.440678 1
126 B4G 0.440678 1
127 GAL GAL GAL 0.440678 1
128 BGC GLC GLC GLC GLC 0.440678 1
129 CE8 0.440678 1
130 BMA BMA BMA 0.440678 1
131 GLC BGC BGC BGC 0.440678 1
132 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.440678 1
133 CE6 0.440678 1
134 ACY 1GN GAL 1GN BGC ACY GAL BGC 0.439024 0.6875
135 1GN ACY GAL ACY 1GN BGC GAL BGC 0.439024 0.6875
136 JZR 0.438596 0.714286
137 BHG 0.438596 0.714286
138 GLC HEX 0.438596 0.714286
139 TRE 0.4375 1
140 BMA Z4Y NAG 0.435897 0.717391
141 B7G 0.431034 0.738095
142 KGM 0.431034 0.738095
143 2M4 0.428571 1
144 MBG 0.428571 0.857143
145 MMA 0.428571 0.857143
146 GYP 0.428571 0.857143
147 AMG 0.428571 0.857143
148 GAL GAL SO4 0.424242 0.66
149 BOG 0.423729 0.738095
150 BNG 0.423729 0.738095
151 HSJ 0.423729 0.738095
152 M1P 0.423077 0.697674
153 XGP 0.423077 0.697674
154 G1P 0.423077 0.697674
155 GL1 0.423077 0.697674
156 BGC BGC XYS BGC 0.418919 0.942857
157 GAL FUC 0.416667 0.941176
158 SER MAN 0.416667 0.72093
159 XYT 0.415385 0.767442
160 BQZ 0.415094 0.909091
161 6SA 0.414894 0.733333
162 GAL BGC NAG GAL 0.413333 0.733333
163 GAL BGC BGC XYS 0.410959 0.942857
164 BGC BGC BGC GLC BGC BGC 0.409836 1
165 GLC BGC BGC BGC BGC BGC BGC 0.409836 1
166 GLA EGA 0.409836 0.942857
167 DGD 0.409639 0.733333
168 BMA NAG MAN MAN MAN MAN MAN MAN MAN 0.409091 0.733333
169 NAG NAG BMA MAN MAN 0.406977 0.6875
170 T6P 0.40678 0.767442
171 GLA GAL GAL 0.40625 1
172 IAB 0.404494 0.733333
173 MAN MAN BMA 0.403226 1
174 BMA BMA MAN 0.403226 1
175 GLC BGC BGC XYS BGC XYS XYS 0.402597 0.942857
176 BGC BGC BGC XYS BGC XYS XYS 0.402597 0.942857
177 BGC BGC XYS BGC XYS BGC XYS 0.402597 0.942857
178 BMA MAN MAN MAN 0.4 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1UGY; Ligand: GLA GLC; Similar sites found with APoc: 92
This union binding pocket(no: 1) in the query (biounit: 1ugy.bio1) has 8 residues
No: Leader PDB Ligand Sequence Similarity
1 4O4F IHP None
2 3N5C GDP None
3 1RZ0 FAD None
4 5MFI LYS ARG LYS ARG LYS ARG LYS ARG None
5 1RZ1 FAD None
6 3ZO7 K6H 2.12766
7 5FUS DAO 2.25564
8 1N1G BCP 2.25564
9 1C1X HFA 3.00752
10 3CW9 01A 3.00752
11 1BW9 PPY 3.00752
12 4ZRN NAD 3.00752
13 4ZRN UPG 3.00752
14 2QTR NXX 3.00752
15 1BXG HCI 3.00752
16 2PI8 NAG NAG NAG NAG NAG NAG 3.7594
17 4ETZ C2E 3.7594
18 6AYU F6P 3.7594
19 4GLL NAD 3.7594
20 5HGZ ACO 4.51128
21 4P8X NAG NAG NAG NAG NAG NAG 4.51128
22 5XWV NDP 4.51128
23 5XWV 8H6 4.51128
24 1JQ3 AAT 5.26316
25 4RDN 6MD 5.26316
26 3D1R FBP 6.01504
27 3AWJ COA 6.01504
28 6H3O FAD 6.01504
29 2C9O ADP 6.01504
30 5JQ1 ZPF 6.01504
31 1MUU NAD 6.76692
32 4OOP DUP 6.76692
33 1T66 FLU 6.76692
34 3SIG AR6 6.76692
35 5IBP ACE ASP GLU VAL ASP 0QE 7.5188
36 1PN0 IPH 7.5188
37 1PN0 FAD 7.5188
38 4X1T UDP 7.5188
39 5ZI9 FLC 7.5188
40 1V9A SAH 7.5188
41 4JD3 COA 7.5188
42 4JD3 PLM 7.5188
43 2OFW ADX 8.27068
44 5YJF SAH 9.02256
45 4ZNO SUC 9.02256
46 5YJF 8WO 9.02256
47 3QOX SAH 9.02256
48 5N2I NAP 9.02256
49 4HVA 4HV 9.77444
50 3EWC MCF 9.77444
51 1ELI PYC 9.77444
52 3TKY SAH 9.77444
53 6BSX E7S 9.77444
54 1G3Q ADP 9.77444
55 1V25 ANP 10.5263
56 2BJU IH4 12.0301
57 1HDR NAD 12.0301
58 2D3M COA 12.782
59 4V03 ADP 12.782
60 1IGJ DGX 13.5338
61 3ZQ6 ADP ALF 13.5338
62 5YRI GLC GLC 14.2857
63 5YRL GLC GLC 14.2857
64 5YRJ BGC GLC 14.2857
65 5YRF GLC GLC 14.2857
66 5YRG BGC GLC 14.2857
67 5YRM BGC GLC 14.2857
68 1OFD AKG 14.2857
69 1OFD FMN 14.2857
70 3O9L LPN 15.0376
71 4WOE ADP 15.0376
72 3D91 REM 17.2932
73 5KMS NAD 18.797
74 5KMS FAD 18.797
75 3AJ6 NGA 21.8045
76 4YDD MGD 24.0602
77 4YDD MD1 24.0602
78 3AD8 NAD 30
79 3HRD FAD 30
80 3R51 MMA 34.5865
81 5XFH NAG MAN BMA MAN NAG GAL 35
82 3LL2 MAN MAN MAN MAN MAN MAN MAN MAN 37.3984
83 2GUD MAN 37.7049
84 2GUC MAN 37.7049
85 2HYR BGC GLC 37.7049
86 2NU5 NAG 37.7049
87 2GUD BMA 37.7049
88 2HYQ MAN MAN 37.7049
89 2NUO BGC 37.7049
90 2GUE NAG 37.7049
91 3VY6 BGC BGC 40.6015
92 1EX7 5GP 45
Pocket No.: 2; Query (leader) PDB : 1UGY; Ligand: GLA BGC; Similar sites found with APoc: 93
This union binding pocket(no: 2) in the query (biounit: 1ugy.bio1) has 8 residues
No: Leader PDB Ligand Sequence Similarity
1 4O4F IHP None
2 1RZ0 FAD None
3 1RZ1 FAD None
4 2UYT LRH 1.50376
5 2UYT ADP 1.50376
6 3ZO7 K6H 2.12766
7 5FUS DAO 2.25564
8 1N1G BCP 2.25564
9 1BW9 PPY 3.00752
10 4ZRN NAD 3.00752
11 4ZRN UPG 3.00752
12 5LYH 7B8 3.00752
13 1C1X HFA 3.00752
14 4BG4 ADP 3.00752
15 2QTR NXX 3.00752
16 6AYU F6P 3.7594
17 2PI8 NAG NAG NAG NAG NAG NAG 3.7594
18 1M15 ADP 3.7594
19 1M15 ARG 3.7594
20 5HGZ ACO 4.51128
21 4QRH 0O2 4.51128
22 4P8X NAG NAG NAG NAG NAG NAG 4.51128
23 6DNT NAD 4.51128
24 1JQ3 AAT 5.26316
25 4RDN 6MD 5.26316
26 1TUF AZ1 5.26316
27 1S9D GDP 5.26316
28 3D1R FBP 6.01504
29 5XNC MTA 6.01504
30 2C9O ADP 6.01504
31 3DLS ADP 6.76692
32 1T66 FLU 6.76692
33 4OOP DUP 6.76692
34 2D24 XYS XYS 6.76692
35 5IBP ACE ASP GLU VAL ASP 0QE 7.5188
36 4JD3 PLM 7.5188
37 4JD3 COA 7.5188
38 1PN0 IPH 7.5188
39 1PN0 FAD 7.5188
40 2OFW ADX 8.27068
41 4ZNO SUC 9.02256
42 5YJF SAH 9.02256
43 3QOX SAH 9.02256
44 3GC8 B45 9.02256
45 5YJF 8WO 9.02256
46 2IW1 U2F 9.02256
47 5N2I NAP 9.02256
48 4HVA 4HV 9.77444
49 1ELI PYC 9.77444
50 1V25 ANP 10.5263
51 3B6Z CO7 10.5263
52 3LDQ 3P1 10.5263
53 1SSQ CYS 11.2782
54 1HDR NAD 12.0301
55 2A14 SAH 13.5338
56 5YRI GLC GLC 14.2857
57 5YRL GLC GLC 14.2857
58 5YRJ BGC GLC 14.2857
59 5YRF GLC GLC 14.2857
60 5YRG BGC GLC 14.2857
61 5YRM BGC GLC 14.2857
62 1OFD AKG 14.2857
63 1OFD FMN 14.2857
64 3O9L LPN 15.0376
65 4WOE ADP 15.0376
66 3D91 REM 17.2932
67 5KMS FAD 18.797
68 4A05 CTT 19.5489
69 3KRB NAP 20.3008
70 3AJ6 NGA 21.8045
71 1U6R ADP 21.8045
72 1VRP ADP 21.8045
73 4YDD MGD 24.0602
74 4YDD MD1 24.0602
75 3AD8 NAD 30
76 2GV8 FAD 30
77 3HRD FAD 30
78 2GAG NAD 30
79 2GVC FAD 30
80 2AZC 3TL 30
81 3R51 MMA 34.5865
82 5XFH NAG MAN BMA MAN NAG GAL 35
83 1NUS APC 35
84 3LL2 MAN MAN MAN MAN MAN MAN MAN MAN 37.3984
85 2GUD MAN 37.7049
86 2GUC MAN 37.7049
87 2HYR BGC GLC 37.7049
88 2NU5 NAG 37.7049
89 2GUD BMA 37.7049
90 2HYQ MAN MAN 37.7049
91 2NUO BGC 37.7049
92 2GUE NAG 37.7049
93 3VY6 BGC BGC 40.6015
94 1YBH FAD 50
Pocket No.: 3; Query (leader) PDB : 1UGY; Ligand: GLA BGC; Similar sites found with APoc: 62
This union binding pocket(no: 3) in the query (biounit: 1ugy.bio1) has 9 residues
No: Leader PDB Ligand Sequence Similarity
1 2FLI DX5 None
2 5DXV NAP None
3 3F5O UOC COA None
4 4XGU ADP 1.50376
5 1IIM TTP 2.25564
6 2E5V FAD 3.7594
7 2WK9 PLG 3.7594
8 3BOF HCS 4.51128
9 5TV6 PML 4.51128
10 1Q8A HCS 4.51128
11 5NUE NAD 4.51128
12 5NUF NAD 4.51128
13 2Y24 XYP XYP GCV XYP 4.51128
14 5XWV 8H6 4.51128
15 3MAX LLX 4.51128
16 4E5N NAD 5.26316
17 1QZR CDX 5.26316
18 1QZR ANP 5.26316
19 2PK3 A2R 5.26316
20 4KQL 1SG 5.26316
21 5X1M THG 6.01504
22 5X1M DHB 6.01504
23 3AWJ COA 6.01504
24 2II3 CAO 6.01504
25 4TUO SIA GAL SIA GLC NGA 6.76692
26 3KL3 BDP 6.76692
27 2X68 CTE 6.76692
28 2JG1 TA6 6.76692
29 4U8P UDP 7.5188
30 4U8P FDA 7.5188
31 4X1T UDP 7.5188
32 2XIQ MLC 8.27068
33 1REO FAD 9.02256
34 2IID PHE 9.02256
35 2IID FAD 9.02256
36 3TKY SAH 9.77444
37 4DSG FAD 9.77444
38 3EYA TDP 10.5263
39 4MO2 FDA 11.2782
40 4MO2 FAD 11.2782
41 2BJU IH4 12.0301
42 1NFS DED 12.0301
43 5TS5 FAD 12.0301
44 4V03 ADP 12.782
45 2D3M COA 12.782
46 2DPM SAM 14.2857
47 2QTV GNP 14.2857
48 1V8B NAD 15
49 3ZZH ARG 15
50 1BGV GLU 15
51 1I8T FAD 15.7895
52 5M67 NAD 16.5414
53 1JNR FAD 17.2932
54 1REQ DCA 20
55 5G09 6DF 20.3008
56 1ZXM ANP 25
57 3ZM6 2GN 28.5714
58 1HKU NAD 35
59 2IVF MGD 40
60 2ZJ1 NAD 40
61 2ZJ1 ARJ 40
62 4Z24 FAD 45
Pocket No.: 4; Query (leader) PDB : 1UGY; Ligand: GLA GLC; Similar sites found with APoc: 74
This union binding pocket(no: 4) in the query (biounit: 1ugy.bio1) has 9 residues
No: Leader PDB Ligand Sequence Similarity
1 4O4F ATP None
2 3V3L V3L None
3 2PR5 FMN None
4 5SVV FMN None
5 5DJU FMN 1.50376
6 2V0U FMN 1.50376
7 4EES FMN 1.73913
8 5TTJ FAD 3.00752
9 1LVG ADP 3.00752
10 2HQM FAD 3.00752
11 2WK9 PLP 3.7594
12 2WK9 PLG 3.7594
13 2V5X V5X 3.7594
14 1MO9 FAD 3.7594
15 1MO9 KPC 3.7594
16 5YJI 8WO 3.7594
17 5YJI SAH 3.7594
18 3A4X NAG NAG NAG NDG 3.7594
19 4QRH 0O2 4.51128
20 1QZR CDX 5.26316
21 1QZR ANP 5.26316
22 2C5A NAD 5.26316
23 2C5A GDC 5.26316
24 1WDI CIT 5.26316
25 3QT6 2P0 5.26316
26 1NBU PH2 5.88235
27 5E4R NAP 6.01504
28 4GLJ RHB 6.01504
29 3HKW IX6 6.01504
30 3E5A VX6 6.01504
31 5XNC MTA 6.01504
32 4TUO SIA GAL SIA GLC NGA 6.76692
33 4PHR UDP 6.76692
34 1G51 AMP 7.5188
35 3IS2 FAD 7.5188
36 3D72 FAD 7.5188
37 5THY SAH 7.5188
38 1KA1 A3P 8.27068
39 2XIQ MLC 8.27068
40 4X7R UDP 8.27068
41 1KYV RBF 8.27068
42 4X7R 3YW 8.27068
43 3QFA FAD 9.02256
44 3GC8 B45 9.02256
45 2MBR FAD 9.77444
46 2MBR EPU 9.77444
47 1LUA NAP 9.77444
48 5DJT FMN 9.83607
49 3EYA TDP 10.5263
50 1YKF NAP 10.5263
51 4XTR ATP 10.5263
52 1POC GEL 11.2782
53 1SSQ CYS 11.2782
54 2A14 SAH 13.5338
55 6F3N NAD 14.2857
56 6F3N ADN 14.2857
57 6F3M NAD 14.2857
58 1FEC FAD 14.2857
59 5M67 3D1 16.5414
60 5M67 NAD 16.5414
61 1JNR FAD 17.2932
62 2Z6D FMN 19.2308
63 4I3V NAD 21.0526
64 1U6R ADP 21.8045
65 1VRP ADP 21.8045
66 4NV7 COA 23.3083
67 5K0A FAD 24.812
68 1ZXM ANP 25
69 1BZL FAD 29.3233
70 3S43 478 30
71 1B4P GPS 30
72 5HSA FAS 40
73 2ZJ1 ARJ 40
74 2ZJ1 NAD 40
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