Receptor
PDB id Resolution Class Description Source Keywords
3V91 2 Å EC: 2.4.1.186 STRUCTURE OF T82M GLYCOGENIN MUTANT TRUNCATED AT RESIDUE 270 WITH UDP-GLUCOSE ORYCTOLAGUS CUNICULUS TRANSFERASE
Ref.: STRUCTURAL AND BIOCHEMICAL INSIGHT INTO GLYCOGENIN INACTIVATION BY THE GLYCOGENOSIS-CAUSING T82M MUTAT FEBS LETT. V. 586 254 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:302;
Invalid;
none;
submit data
35.453 Cl [Cl-]
GOL A:301;
Invalid;
none;
submit data
92.094 C3 H8 O3 C(C(C...
MN A:303;
Part of Protein;
none;
submit data
54.938 Mn [Mn+2...
UPG A:304;
Valid;
none;
submit data
566.302 C15 H24 N2 O17 P2 C1=CN...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3V91 2 Å EC: 2.4.1.186 STRUCTURE OF T82M GLYCOGENIN MUTANT TRUNCATED AT RESIDUE 270 WITH UDP-GLUCOSE ORYCTOLAGUS CUNICULUS TRANSFERASE
Ref.: STRUCTURAL AND BIOCHEMICAL INSIGHT INTO GLYCOGENIN INACTIVATION BY THE GLYCOGENOSIS-CAUSING T82M MUTAT FEBS LETT. V. 586 254 2012
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3V91 - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
2 3V8Z - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
70% Homology Family (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3V91 - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
2 3V8Z - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
3 3U2V - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
4 3QVB - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
5 3T7M - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
6 3U2W - LCN C6 H10 O5 C1=C([C@H]....
7 3T7O - GLC C6 H12 O6 C([C@@H]1[....
8 3T7N - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
9 3U2U - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
10 3RMW - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
11 3RMV - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
12 1ZDF - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
13 1ZDG - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
14 1LL2 - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
50% Homology Family (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3V91 - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
2 3V8Z - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
3 3U2V - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
4 3QVB - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
5 3T7M - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
6 3U2W - LCN C6 H10 O5 C1=C([C@H]....
7 3T7O - GLC C6 H12 O6 C([C@@H]1[....
8 3T7N - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
9 3U2U - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
10 3RMW - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
11 3RMV - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
12 1ZDF - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
13 1ZDG - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
14 1LL2 - UPG C15 H24 N2 O17 P2 C1=CN(C(=O....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: UPG; Similar ligands found: 94
No: Ligand ECFP6 Tc MDL keys Tc
1 GDU 1 1
2 UFM 1 1
3 UPG 1 1
4 GUD 1 1
5 USQ 0.8 0.846154
6 UFG 0.797619 0.943662
7 U2F 0.797619 0.943662
8 UPF 0.797619 0.943662
9 UD1 0.73913 0.985294
10 UD2 0.73913 0.985294
11 UGB 0.738636 0.985075
12 UGA 0.738636 0.985075
13 UDP 0.717949 0.941176
14 UDX 0.715909 0.970588
15 UAD 0.715909 0.970588
16 UDP GAL 0.715909 0.970588
17 UTP 0.7125 0.941176
18 IUG 0.693878 0.835443
19 G3N 0.692308 0.942857
20 C5G 0.688889 0.943662
21 URM 0.681818 0.956522
22 660 0.681818 0.956522
23 UPU 0.670588 0.970149
24 EPZ 0.650485 0.971014
25 3UC 0.648936 0.943662
26 UNP 0.647059 0.914286
27 EEB 0.644231 0.957143
28 EPU 0.644231 0.957143
29 U5P 0.641026 0.926471
30 HP7 0.636364 0.970588
31 UD7 0.636364 0.956522
32 2GW 0.632653 0.957143
33 MJZ 0.63 0.942857
34 UD4 0.623762 0.942857
35 UDH 0.615385 0.866667
36 UPP 0.615385 0.942029
37 UDZ 0.615385 0.88
38 UMA 0.598214 0.971014
39 44P 0.597561 0.901408
40 UDM 0.59596 0.942857
41 12V 0.592233 0.929577
42 HWU 0.592233 0.929577
43 1GW 0.590476 0.917808
44 2KH 0.586207 0.914286
45 Y6W 0.585106 0.916667
46 UDP UDP 0.576471 0.911765
47 U22 0.567797 0.8375
48 U21 0.567797 0.858974
49 U20 0.567797 0.858974
50 URI 0.552632 0.865672
51 U 0.552632 0.865672
52 CJB 0.551282 0.850746
53 UP5 0.527273 0.855263
54 UAG 0.523438 0.917808
55 2QR 0.520325 0.848101
56 DAU 0.519608 0.891892
57 U3P 0.511905 0.911765
58 UA3 0.511905 0.911765
59 CSQ 0.504762 0.878378
60 CSV 0.504762 0.878378
61 4TC 0.504425 0.833333
62 U U 0.5 0.927536
63 4RA 0.492308 0.857143
64 UD0 0.484848 0.846154
65 PUP 0.480392 0.887324
66 UML 0.478571 0.858974
67 U2P 0.476744 0.926471
68 CXY 0.471154 0.916667
69 GDD 0.463636 0.8
70 GKE 0.463636 0.8
71 GDC 0.463636 0.8
72 A U 0.461538 0.831169
73 CTP 0.447917 0.888889
74 CDP 0.446809 0.888889
75 CH 0.444444 0.861111
76 ADQ 0.443396 0.828947
77 DKX 0.44186 0.774648
78 U2S 0.43956 0.77027
79 UMF 0.438202 0.833333
80 U4S 0.433333 0.733333
81 DUT 0.43299 0.861111
82 U3S 0.423913 0.756757
83 5GW 0.421569 0.915493
84 DUD 0.421053 0.861111
85 5FU 0.417582 0.863014
86 C2G 0.417476 0.902778
87 UPA 0.416667 0.868421
88 7XL 0.415842 0.890411
89 U1S 0.415842 0.776316
90 U U U U 0.413462 0.913043
91 2TU 0.411765 0.777778
92 UTP U U U 0.409524 0.897059
93 139 0.406504 0.835443
94 APU 0.401639 0.831169
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3V91; Ligand: UPG; Similar sites found: 307
This union binding pocket(no: 1) in the query (biounit: 3v91.bio2) has 24 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1SS4 GSH 0.003554 0.51357 None
2 2O66 FLC 0.002815 0.46485 None
3 1SS4 CIT 0.02658 0.45722 None
4 1C1L GAL BGC 0.01453 0.44162 None
5 3RF4 FUN 0.006818 0.44129 None
6 4PNO U5P 0.003581 0.43505 None
7 4IEN GDP 0.0003866 0.43128 None
8 4F4S EFO 0.01406 0.42674 None
9 2E1A MSE 0.01527 0.42065 None
10 1YRX FMN 0.01401 0.41052 None
11 2NSJ C2R 0.0113 0.41046 None
12 3UC5 ATP 0.000003541 0.40522 None
13 4IEN COA 0.0009984 0.40132 None
14 3P7I P7I 0.007925 0.43827 0.934579
15 3P3N AKG 0.01131 0.44138 1.37457
16 4LHM AZZ 0.02134 0.42284 1.37457
17 2WA4 069 0.0141 0.4141 1.37457
18 2Y7G AAE 0.00537 0.42383 1.41844
19 3VGL BGC 0.00007987 0.44789 1.71821
20 3VGL ANP 0.0000227 0.43693 1.71821
21 4J6O CIT 0.02016 0.41033 1.71821
22 1QDS PGA 0.01675 0.41475 1.99203
23 4LTN NAI 0.00001462 0.41343 2.03046
24 2WL9 MBD 0.00003736 0.47464 2.06186
25 2P8B NSK 0.000007137 0.4601 2.06186
26 2Q1A 2KT 0.0004515 0.44521 2.06186
27 2O2C G6Q 0.002305 0.43862 2.06186
28 2OWZ F6P 0.0000003769 0.43594 2.06186
29 1KW6 BPY 0.000008815 0.43099 2.06186
30 1JQ5 NAD 0.0001866 0.43046 2.06186
31 1XMV ADP 0.000004596 0.42816 2.06186
32 4A8H PUW 0.0003871 0.42176 2.06186
33 1KTC NGA 0.02059 0.41903 2.06186
34 2BH9 NAP 0.0125 0.40902 2.06186
35 4A8T PAO 0.0001376 0.40289 2.06186
36 4MIX UD1 0.01192 0.40198 2.06186
37 3NOJ PYR 0.0005319 0.49579 2.10084
38 1FX8 BOG 0.0003561 0.46633 2.13523
39 4JWX 1N4 0.006201 0.4432 2.14286
40 1NYT NAP 0.003969 0.40262 2.21402
41 1J2Z SOG 0.003675 0.42849 2.22222
42 2F2U M77 0.01702 0.41444 2.23881
43 2EB5 OXL 0.0008154 0.49755 2.24719
44 1T10 F6P 0.008839 0.44117 2.4055
45 1ME8 RVP 0.00001162 0.43993 2.4055
46 2JBH 5GP 0.006179 0.43832 2.4055
47 3HB5 E2B 0.0006943 0.43133 2.4055
48 4IVG ANP 0.00001409 0.41605 2.4055
49 4WVH ASP HIS ASP ALA HIS ALA 0.02188 0.41359 2.4055
50 2D7I UDP 0.01597 0.40322 2.4055
51 2P2V CSF 0.00000622 0.41665 2.43056
52 3A2Y TS5 0.01642 0.40098 2.53807
53 1VE3 SAM 0.01252 0.40242 2.64317
54 3OCZ SRA 0.008533 0.41218 2.67176
55 1Q3Q ANP 0.00001166 0.42426 2.73723
56 1O9U ADZ 0.003766 0.48673 2.74914
57 4E28 9MZ 0.0167 0.43303 2.74914
58 3UXL CFI 0.00007135 0.42571 2.74914
59 4QN6 LNV 0.00006154 0.42533 2.74914
60 1AL8 FMN 0.000003747 0.42108 2.74914
61 2YYJ 4HP 0.00009878 0.41828 2.74914
62 2YYJ FAD 0.00009878 0.41828 2.74914
63 4E28 0MZ 0.0277 0.41739 2.74914
64 1FWY UD1 0.0004272 0.41607 2.74914
65 1HV9 UD1 0.0004657 0.41497 2.74914
66 4GZP G39 0.0001002 0.41421 2.74914
67 1RHC F42 ACN 0.0008088 0.41344 2.74914
68 1TZJ A3B 0.02175 0.41034 2.74914
69 4AF0 IMP 0.0000356 0.40482 2.74914
70 1YOE RIB 0.000001816 0.4017 2.74914
71 2Y7P SAL 0.02581 0.41445 2.75229
72 4FUA PGH 0.0000819 0.455 2.7907
73 2FOI JPA 0.02627 0.40615 2.97398
74 2BLE 5GP 0.00003436 0.41527 2.99728
75 1QO0 BMD 0.0005377 0.50643 3.06122
76 3DGB MUC 0.0008673 0.46551 3.09278
77 1X1T NAD 0.0000006947 0.46488 3.09278
78 1GR0 NAD 0.000002314 0.45394 3.09278
79 3DER ALA LYS 0.001486 0.43402 3.09278
80 1Z41 FMN 0.004974 0.42517 3.09278
81 2Z9V PXM 0.01559 0.42465 3.09278
82 1Z44 FMN 0.007561 0.42162 3.09278
83 4OB6 S2T 0.008794 0.41519 3.09278
84 1CKM GTP 0.005616 0.41242 3.09278
85 2VL8 UDP 0.002165 0.40921 3.09278
86 1YBH FAD 0.0003161 0.40814 3.09278
87 4GQB 0XU 0.00004458 0.40687 3.09278
88 2BII MTV 0.004857 0.40536 3.09278
89 2VL8 CTS 0.002401 0.40385 3.09278
90 2AEB ABH 0.000003718 0.40302 3.09278
91 4M4K XYP XYP 0.003566 0.41139 3.13589
92 5DS8 GLY 5CT GLY ALA 0.04915 0.41952 3.15315
93 2C1Q BTN 0.00001234 0.40417 3.1746
94 3SUC ATP 0.00001022 0.40461 3.23834
95 5DRN 5CT 0.04653 0.42967 3.24074
96 1A8S PPI 0.0006719 0.4729 3.2967
97 1S8F GDP 0.01214 0.41311 3.38983
98 1MZV AMP 0.02676 0.4058 3.40426
99 3VOZ 04A 0.000125 0.48416 3.43643
100 1GJW GLC 0.02055 0.43391 3.43643
101 1P4C FMN 0.00001332 0.43037 3.43643
102 1Q11 TYE 0.01509 0.42531 3.43643
103 1GJW MAL 0.02552 0.40671 3.43643
104 2QV7 ADP 0.01459 0.4063 3.43643
105 3MD0 GDP 0.03527 0.40417 3.43643
106 1SJW NGV 0.00002463 0.43598 3.47222
107 2X61 NGA GAL SIA 0.000001148 0.44757 3.48837
108 2X61 CH 0.000002017 0.42071 3.48837
109 1TUV VK3 0.01867 0.44857 3.50877
110 3PHQ KDO 0.008753 0.49253 3.68664
111 1UGX GAL MGC 0.000002272 0.49637 3.7594
112 4QDF 30Q 0.00005803 0.45793 3.78007
113 1F1V DHY 0.005831 0.43945 3.78007
114 5T63 ALA ALA ALA ALA 0.0007462 0.43742 3.78007
115 2C9O ADP 0.0001178 0.43258 3.78007
116 1O0S NAI 0.0008897 0.4311 3.78007
117 1UF5 CDT 0.00808 0.42861 3.78007
118 3Q3C NAD 0.00003648 0.40885 3.78007
119 1E5F PLP 0.013 0.40834 3.78007
120 3NKT 1HN 0.003378 0.40217 3.78007
121 4IXW IXW 0.03613 0.40369 3.93701
122 2ET1 GLV 0.00002554 0.4325 3.9801
123 2Z9C FMN 0.004643 0.41551 4
124 1BGV GLU 0.00009558 0.41743 4.00891
125 2HZQ STR 0.007654 0.43406 4.02299
126 1EDO NAP 0.000002334 0.45032 4.09836
127 3UEC ALA ARG TPO LYS 0.01962 0.43494 4.10959
128 1A5Z OXM 0.0002029 0.54551 4.12371
129 1A5Z FBP 0.00003597 0.49441 4.12371
130 1T26 NAI 0.0000007015 0.47961 4.12371
131 1T26 GBD 0.0000007015 0.47961 4.12371
132 3K37 BCZ 0.000003214 0.45213 4.12371
133 4QCK ASD 0.000198 0.44612 4.12371
134 1A5Z NAD 0.000002117 0.43212 4.12371
135 3SHR CMP 0.007351 0.4304 4.12371
136 1LTH NAD 0.000005043 0.42838 4.12371
137 3AIQ HBO 0.00001575 0.42058 4.12371
138 5AYC BGC BMA 0.003773 0.40769 4.12371
139 1SJD NPG 0.004814 0.4026 4.12371
140 1RSD PSB 0.00281 0.40793 4.13223
141 3OIG NAD 0.00002602 0.41809 4.13534
142 1ZS6 ADP 0.0267 0.40967 4.14201
143 4PTZ FMN 0.001083 0.44738 4.18848
144 3QDY A2G GAL 0.01128 0.45358 4.1958
145 3QDY CBS 0.00899 0.45227 4.1958
146 3QDT A2G GAL 0.02771 0.43286 4.1958
147 2C2A ADP 0.005713 0.41904 4.26357
148 1EYE PMM 0.0037 0.4388 4.28571
149 2YCD GTB 0.02031 0.40734 4.34783
150 2ZO9 MLI 0.001524 0.45763 4.46735
151 4B9E FAH 0.01348 0.44328 4.46735
152 1SAY PYR 0.0001363 0.43094 4.46735
153 1SQ5 PAU 0.01897 0.42069 4.46735
154 2PR5 FMN 0.00499 0.41776 4.46735
155 1WDA BAG 0.01813 0.41729 4.46735
156 3HPF GAE 0.000001858 0.41607 4.46735
157 4PNI KQQ 0.001962 0.41592 4.46735
158 1SQ5 ADP 0.01367 0.41468 4.46735
159 2HNK SAH 0.006551 0.40991 4.60251
160 1Y0L HAN 0.02538 0.44461 4.62963
161 1I9G SAM 0.00003479 0.40261 4.64286
162 2WGC SIA GAL BGC 0.03291 0.4494 4.67836
163 1WGC SIA GAL BGC 0.03206 0.44237 4.67836
164 1BDB NAD 0.0000161 0.43175 4.69314
165 3IOI 1GW 0.00002074 0.51745 4.811
166 1I0Z OXM 0.02255 0.44404 4.811
167 1DXY NAD 0.00003394 0.43518 4.811
168 2ZJ5 ADP 0.01451 0.43088 4.811
169 2NVK NAP 0.02295 0.41683 4.811
170 1F8F NAD 0.0000216 0.41608 4.811
171 4G1V FAD 0.0004086 0.40929 4.811
172 2RDT 2RD 0.0001099 0.40845 4.811
173 2RDT FMN 0.00007083 0.40425 4.811
174 3RO7 TDR 0.000919 0.40025 4.90566
175 1K27 MTM 0.0001324 0.43109 4.947
176 1YOA FAD 0.007414 0.40179 5.03145
177 1FW1 GSH 0.02434 0.40053 5.09259
178 2NCD ADP 0.01225 0.43439 5.15464
179 1CTU ZEB 0.005043 0.42117 5.15464
180 2BJF DXC 0.0001292 0.40627 5.15464
181 1L5J TRA 0.02727 0.40349 5.15464
182 3NJQ NJQ 0.0000001035 0.418 5.18135
183 3NFZ 3NF 0.01485 0.41314 5.19878
184 1GU3 BGC BGC BGC BGC BGC 0.04134 0.40486 5.36913
185 2IMP NAI 0.000003303 0.45346 5.42798
186 3F81 STT 0.04688 0.42637 5.46448
187 2YP9 SIA CMO 0.000009203 0.53177 5.49828
188 2PP3 LGT 0.003295 0.43654 5.49828
189 4N02 FNR 0.000003804 0.43116 5.49828
190 2R7K ACP 0.0001117 0.42377 5.49828
191 2R7K AMZ 0.0001117 0.42377 5.49828
192 1V8K ANP 0.0003701 0.42085 5.49828
193 4HZX G39 0.000004536 0.41252 5.49828
194 3TFC PEP 0.0323 0.40989 5.49828
195 2OVW CBI 0.0208 0.40538 5.49828
196 3I51 45C 0.004138 0.43674 5.55556
197 2P6W FLC 0.00001241 0.46453 5.6338
198 2IYG FMN 0.01898 0.4086 5.64516
199 1Y9Q MED 0.01482 0.43559 5.72917
200 3I0O ADP 0.001809 0.45696 5.84192
201 2C5S AMP 0.006015 0.43885 5.84192
202 1LDM NAD 0.00001036 0.43119 5.84192
203 3DG6 MUC 0.005032 0.42894 5.84192
204 3I0O SMI 0.02387 0.4205 5.84192
205 1AF6 GLC FRU 0.01716 0.41658 5.84192
206 2X2T GAL NGA 0.03643 0.40378 5.88235
207 1JA9 NDP 0.0000001276 0.48074 6.20438
208 4F8L GAL 0.008535 0.48459 6.2069
209 1EJE FMN 0.000937 0.44558 6.25
210 2GN2 C5P 0.0000801 0.49173 6.43275
211 2QLX RM4 0.01952 0.43505 6.48148
212 1U5R ATP 0.0032 0.43289 6.52921
213 4OYA 1VE 0.00007058 0.43064 6.52921
214 1V5F FAD 0.0007563 0.41861 6.52921
215 1V5F TPP 0.0007563 0.41861 6.52921
216 3TI8 LNV 0.0001309 0.41121 6.52921
217 4HPP GLU 0.000001704 0.41096 6.52921
218 1ULE GLA GAL NAG 0.0208 0.43949 6.66667
219 2GJ3 FAD 0.00005609 0.42158 6.66667
220 2Y6P CTP 0.007824 0.42922 6.83761
221 3TKA CTN 0.01599 0.45356 6.87285
222 2Z5Y HRM 0.000055 0.45297 6.87285
223 4MOB ADP 0.00149 0.44407 6.87285
224 1ONX ASP 0.0001986 0.44243 6.87285
225 1YBQ BDH 0.00008581 0.42728 6.87285
226 4CMF PXG 0.000008991 0.42044 6.87285
227 1HYE NAP 0.006869 0.40009 6.87285
228 3D2Y AH0 ALA FGA LYS 0.001726 0.43543 6.89655
229 2PVQ GSH 0.009755 0.40989 6.96517
230 2FH5 GTP 0.001708 0.43176 7.00935
231 4IRP UDP 0.00071 0.4878 7.17131
232 2BGM NAJ 0.0000003545 0.45939 7.19424
233 3PLN U5P 0.001967 0.46624 7.2165
234 1JQN DCO 0.0000073 0.4644 7.2165
235 3Q2I HP7 0.00001834 0.4235 7.2165
236 2RHQ GAX 0.005816 0.40557 7.2165
237 1VQ2 DDN 0.0000009847 0.45341 7.25389
238 2NLI LAC 0.000004769 0.4353 7.56014
239 1I2B NAD 0.0001175 0.43408 7.56014
240 1I2B USQ 0.0001175 0.43408 7.56014
241 1I2B UPG 0.0001175 0.43408 7.56014
242 2NLI FMN 0.000004396 0.43407 7.56014
243 2Q09 DI6 0.008369 0.4324 7.56014
244 4COQ SAN 0.02846 0.42153 7.56014
245 1RM4 NDP 0.00005747 0.41005 7.56014
246 1O7Q UDP 0.00002982 0.43901 7.61246
247 1EXB NDP 0.0001816 0.40621 7.76699
248 2XD9 XD9 0.0003886 0.42428 7.78443
249 3CU0 GAL GAL SO4 0.009457 0.40321 7.82918
250 1TV5 N8E 0.002169 0.43163 7.90378
251 1TV5 ORO 0.003961 0.4272 7.90378
252 1TV5 FMN 0.00003731 0.41968 7.90378
253 4B2D SER 0.02264 0.41865 7.90378
254 1QZZ SAM 0.01262 0.41241 7.90378
255 1VCO GLN 0.002356 0.40729 7.90378
256 1TV5 A26 0.007794 0.40102 7.90378
257 2QCX PF1 0.04336 0.40797 7.98479
258 2W24 LYS 0.000409 0.42564 8
259 4K30 NLG 0.01578 0.4244 8.125
260 4Q3S X7A 0.000583 0.42551 8.24742
261 3GTD MLI 0.03965 0.40986 8.24742
262 3KJQ B94 0.02143 0.40634 8.42105
263 1ZJ6 G3D 0.01954 0.40806 8.55615
264 2IZ1 ATR 0.03881 0.41481 8.59107
265 3OBT SLB 0.01872 0.41084 8.59107
266 1KYQ NAD 0.00421 0.42059 8.75912
267 4TMK T5A 0.001253 0.40252 8.92019
268 3OYZ ACO 0.00008233 0.42337 9.27835
269 3SJU NDP 0.000846 0.41003 9.319
270 1Y75 NAG 0.007118 0.43557 9.32203
271 3FPZ AHZ 0.00001347 0.43835 10.3093
272 3QVL 5HY 0.00005323 0.4041 10.3093
273 2GGH NLQ 0.00001442 0.44884 10.6529
274 1ZFJ IMP 0.00001873 0.44431 10.6529
275 1G8S MET 0.02182 0.42726 10.8696
276 4KCT PYR 0.002343 0.45722 10.9966
277 4M5P 23W 0.009879 0.45663 10.9966
278 4M5P MLA 0.04717 0.43263 10.9966
279 3GJB AKG 0.02903 0.40802 10.9966
280 4M5P FMN 0.006488 0.4069 10.9966
281 4KCT FDP 0.02612 0.40266 10.9966
282 1ECM TSA 0.03283 0.40559 11.0092
283 3S9K CIT 0.006618 0.49439 11.0169
284 3R51 MMA 0.01281 0.45756 11.25
285 1QD0 RR6 0.02318 0.40488 11.7188
286 3KMT SAH 0.003296 0.43654 11.7647
287 1MVQ MMA 0.00001833 0.46014 11.8644
288 1XX4 BAM 0.006103 0.44613 11.8774
289 1NVV GNP 0.004442 0.40098 12.0482
290 2JFV FLC 0.01181 0.44045 12.3711
291 1NVU GTP 0.0000004427 0.45482 12.6506
292 3O2K QRP 0.01761 0.4138 12.7148
293 3BMN AX3 0.03705 0.40526 12.8472
294 4CCO OGA 0.004071 0.45165 13.0584
295 1BTN I3P 0.001955 0.52893 13.2075
296 1OMZ UD2 0.003052 0.40484 13.7457
297 1FNZ A2G 0.00001277 0.50044 14.346
298 2HMT NAI 0.00003544 0.40487 15.2778
299 1WKL ATP 0.0005739 0.45373 16.0584
300 3CF6 SP1 0.01149 0.4105 16.1677
301 1GA8 UPF 0.0000007606 0.53058 16.4948
302 1GA8 DEL 0.0000004224 0.49483 16.4948
303 1ZK4 NAP 0.0000176 0.43547 17.5299
304 1ZK4 AC0 0.0000176 0.43547 17.5299
305 3O03 NAP 0.00001645 0.4208 17.8694
306 1GXU 2HP 0.004705 0.40886 18.6813
307 2V5E SCR 0.02486 0.44875 19
Pocket No.: 2; Query (leader) PDB : 3V91; Ligand: UPG; Similar sites found: 184
This union binding pocket(no: 2) in the query (biounit: 3v91.bio1) has 24 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO5 PIH 0.009749 0.45393 None
2 2VKL MLT 0.008539 0.44793 None
3 1BCJ NGA 0.03695 0.41756 1.2987
4 2FR6 URI 0.001726 0.40521 1.36986
5 1WVG APR 0.001412 0.40215 1.71821
6 4NE2 SH2 0.001634 0.41269 1.79641
7 1LYX PGA 0.0001508 0.40076 2.01613
8 4LTN FMN 0.005981 0.40161 2.03046
9 1D6H COA 0.0003544 0.44482 2.06186
10 1F3L SAH 0.0001964 0.42411 2.06186
11 3FC2 IBI 0.0006841 0.41869 2.06186
12 2IXB NAD 0.0009875 0.41483 2.06186
13 2IXB A2G 0.001789 0.41483 2.06186
14 2XVE FAD 0.01324 0.40135 2.06186
15 1TU3 GNP 0.000414 0.41941 2.33918
16 3BHO B4P 0.009687 0.44501 2.40385
17 4M51 BEZ 0.006696 0.43769 2.4055
18 1Y42 TYR 0.007722 0.41117 2.4055
19 1OTH PAO 0.001524 0.4099 2.4055
20 3S7O LBV 0.001453 0.40923 2.4055
21 2VJJ RAM GLC GAL NAG NAG GLC 0.005152 0.40871 2.4055
22 1Q0H FOM 0.004463 0.40793 2.4055
23 4GYW UDP 0.001993 0.40598 2.4055
24 2AQJ FAD 0.009405 0.40554 2.4055
25 2AQJ TRP 0.009968 0.40392 2.4055
26 1Q0H NDP 0.006464 0.40392 2.4055
27 2RGH FAD 0.004873 0.40185 2.4055
28 1A27 NAP 0.002395 0.40063 2.42215
29 4BMO FMN 0.0006111 0.41393 2.52101
30 1NZY BCA 0.0004435 0.4218 2.60223
31 1WVC CTP 0.0004416 0.46837 2.7027
32 4JK3 NAD 0.0005653 0.41992 2.7027
33 2A2X NA9 0.001987 0.40311 2.7027
34 2Q2V NAD 0.0004546 0.42891 2.7451
35 1PEA ACM 0.002725 0.45671 2.74914
36 2G86 UMP 0.0004439 0.44644 2.74914
37 1V35 NAI 0.000426 0.43981 2.74914
38 2J8Z NAP 0.0002131 0.43388 2.74914
39 3T31 DCQ 0.002479 0.42539 2.74914
40 3T31 FAD 0.002247 0.42539 2.74914
41 2J07 FAD 0.001957 0.42336 2.74914
42 2J07 HDF 0.001957 0.42336 2.74914
43 4GLJ RHB 0.0007943 0.41939 2.74914
44 1SB8 NAD 0.002776 0.41705 2.74914
45 2YPO PHE 0.000858 0.41543 2.74914
46 1C0I FAD 0.002888 0.41464 2.74914
47 1C0I BE2 0.002888 0.41464 2.74914
48 1JQI CAA 0.000611 0.41219 2.74914
49 1JQI FAD 0.003311 0.40339 2.74914
50 1SB8 UD2 0.008553 0.40274 2.74914
51 4KCF AKM 0.001236 0.40061 2.74914
52 4KS1 2H8 0.006398 0.40058 2.74914
53 1M5B BN1 0.00263 0.42445 3.04183
54 4KQL 1SG 0.0002301 0.4665 3.09278
55 1Z44 NPO 0.006716 0.46295 3.09278
56 1QF5 RPL 0.002834 0.41673 3.09278
57 1QF5 GDP 0.002834 0.41673 3.09278
58 1DLJ NAI 0.003335 0.41591 3.09278
59 1EP2 ORO 0.001275 0.4151 3.09278
60 2V7T SAH 0.01221 0.41475 3.09278
61 4HA6 FAD 0.003573 0.4095 3.09278
62 1H82 GZZ 0.007935 0.40895 3.09278
63 4DYO SD4 0.006867 0.40844 3.09278
64 1H82 FAD 0.007882 0.40698 3.09278
65 3A1I UNU 0.006502 0.40481 3.09278
66 1DLJ UGA 0.007733 0.40276 3.09278
67 4O1M NAD 0.002271 0.4014 3.09278
68 3SJ7 NDP 0.0009165 0.41299 3.1746
69 1HDR NAD 0.001183 0.43119 3.27869
70 2ZWS PLM 0.00204 0.49173 3.43643
71 1KBI FMN 0.0002654 0.42741 3.43643
72 1KBI PYR 0.0002654 0.42741 3.43643
73 4RJK PYR 0.01515 0.42035 3.43643
74 3T1A 5MA 0.0001626 0.41399 3.43643
75 4KOA NDP 0.00138 0.41264 3.43643
76 2ZJ3 G6P 0.000328 0.40875 3.43643
77 3F3E LEU 0.003613 0.4032 3.43643
78 1OLS TDP 0.005723 0.4032 3.43643
79 2XDQ MGX 0.04587 0.4024 3.43643
80 2HV8 GTP 0.0005747 0.41305 3.48837
81 3H86 AP5 0.007563 0.40022 3.64583
82 1RYI FAD 0.001387 0.42397 3.78007
83 4W6Z 8ID 0.001237 0.41802 3.78007
84 1E7S NAP 0.001143 0.41408 3.78007
85 1RYI GOA 0.004619 0.40557 3.78007
86 2DTX BMA 0.0002937 0.44311 3.78788
87 3PVT 3HC 0.001458 0.41675 3.861
88 2E2R 2OH 0.001741 0.41052 4.09836
89 1ZK7 FAD 0.0004603 0.44291 4.12371
90 3V1U NAD 0.0003234 0.42288 4.12371
91 2R5T ANP 0.0005501 0.41385 4.12371
92 3LTW HLZ 0.006778 0.4245 4.28571
93 3ICC NAP 0.0005735 0.42413 4.31373
94 1TIW TFB 0.002204 0.4117 4.46735
95 1TIW FAD 0.002204 0.4117 4.46735
96 1FIQ FAD 0.001748 0.41046 4.46735
97 3IU9 T07 0.004654 0.4161 4.51389
98 1ZZ7 S0H 0.00845 0.40952 4.54545
99 1OAA OAA 0.00234 0.41597 4.6332
100 3ZPG 5GP 0.01082 0.43456 4.71204
101 1T0I FMN 0.0004459 0.4042 4.71204
102 2PT9 2MH 0.0003362 0.43471 4.811
103 1V6A TRE 0.004033 0.42866 4.811
104 2IMF TOM 0.0001999 0.41304 4.92611
105 2IMF GSH 0.0001999 0.41304 4.92611
106 1YOA FMN 0.003337 0.47985 5.03145
107 2Q8H TF4 0.007169 0.44366 5.15464
108 1AUX AGS 0.0002308 0.40617 5.15464
109 2QF7 COA 0.0001376 0.40369 5.15464
110 1EB9 HBA 0.002302 0.41782 5.34351
111 1UXG FUM 0.002434 0.41021 5.49828
112 1UXG NAD 0.002434 0.41021 5.49828
113 1N9L FMN 0.0006105 0.42068 5.50459
114 4MP8 MLI 0.0005671 0.43083 5.84192
115 4MP8 NAD 0.0005671 0.43083 5.84192
116 1R37 NAD 0.001985 0.40859 5.84192
117 4C12 ADP 0.008283 0.40324 5.84192
118 2Q37 3AL 0.001639 0.44572 6.07735
119 2YC5 6BC 0.003682 0.40067 6.14035
120 2V6O FAD 0.007616 0.41642 6.18557
121 1VDC FAD 0.004308 0.41023 6.18557
122 1JYQ MAZ PTR PTM ASN 0.005459 0.40821 6.25
123 3BY8 MLT 0.01032 0.42209 6.33803
124 4C0X AQN 0.001731 0.40669 6.40394
125 3FC4 EDO 0.001819 0.42791 6.52921
126 3RFV NAI 0.0008688 0.41222 6.52921
127 2H8Z 8CM 0.002213 0.40037 6.52921
128 2H8Z FMN 0.002213 0.40037 6.52921
129 1D09 PAL 0.03228 0.40393 6.53595
130 4QED NAP 0.002122 0.40238 6.85484
131 4FWE FAD 0.002061 0.41791 6.87285
132 1LCP PLU 0.001205 0.40438 6.87285
133 2GSD NAD 0.003133 0.40306 6.87285
134 3ZRR PXG 0.0005325 0.40199 6.87285
135 2YVF NAD 0.005312 0.41608 7.2165
136 2YVF FAD 0.007258 0.41038 7.2165
137 3WE0 FAD 0.004563 0.40575 7.2165
138 4L6C 0BT 0.0006562 0.40751 7.42574
139 1J5P NAD 0.001032 0.40977 7.50988
140 3KMZ EQO 0.00156 0.40075 7.5188
141 1TDF NAP 0.001171 0.44595 7.56014
142 4R33 TRP 0.0003935 0.43102 7.56014
143 4R33 SAH 0.0003935 0.43102 7.56014
144 3NYQ AMP 0.0004492 0.42909 7.56014
145 1TDF FAD 0.001797 0.42288 7.56014
146 3NYQ MCA 0.001023 0.41569 7.56014
147 1R6D DAU 0.006312 0.40752 7.56014
148 1R6D NAD 0.01028 0.40058 7.56014
149 3MAG 3MA 0.0006473 0.50732 7.81759
150 3ZOD HQE 0.0002599 0.42771 7.8534
151 3ZOD FMN 0.0002599 0.42771 7.8534
152 4G87 UD1 0.0004753 0.44292 7.90378
153 3QV9 QV7 0.003005 0.43424 7.90378
154 1LVL FAD 0.001449 0.4233 7.90378
155 1KYZ SAH 0.0001499 0.41535 7.90378
156 1JIL 485 0.0003162 0.4097 7.90378
157 1HFS L04 0.001073 0.415 8.125
158 1C3V NDP 0.002259 0.40284 8.16327
159 4Q3R XA2 0.0002991 0.42398 8.24742
160 4NAT 2W5 0.00163 0.41508 8.75
161 4NAT ADP 0.01989 0.40362 8.75
162 1T0S BML 0.007468 0.43537 8.93471
163 1Z45 UPG 0.0002416 0.40825 8.93471
164 1Z45 NAD 0.001882 0.40411 8.93471
165 3JQ3 ADP 0.003014 0.41804 9.01639
166 1V7R CIT 0.04131 0.4113 9.13978
167 3U4C NDP 0.0002414 0.4321 9.25267
168 3TN7 NJP 0.002571 0.40096 9.33852
169 1KDK DHT 0.0003268 0.41711 9.60452
170 1GSA GSH 0.000198 0.41148 9.96564
171 1GSA ADP 0.006869 0.40298 9.96564
172 1NN5 2DT 0.001649 0.40601 10.6977
173 1NN5 ANP 0.001649 0.40601 10.6977
174 1RZM PEP 0.003493 0.42572 11.3402
175 1I2L DCS 0.000961 0.40986 12.3711
176 4INB 1F6 0.0001692 0.41767 14.3836
177 4NTD FAD 0.001656 0.41599 14.7766
178 2WCI GSH 0.007921 0.41586 16.2963
179 2YB9 HA0 0.00007094 0.45133 16.4948
180 2AE2 PTO 0.004058 0.40462 17.3077
181 2AE2 NAP 0.004058 0.40462 17.3077
182 4DEC UDP 0.00004451 0.4232 19.244
183 4DEC 3PG 0.00004451 0.4232 19.244
184 3F8C HT1 0.0112 0.40928 26.9841
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