Receptor
PDB id Resolution Class Description Source Keywords
2AE7 2 Å EC: 2.4.1.90 CRYSTAL STRUCTURE OF HUMAN M340H-BETA1,4-GALACTOSYLTRANSFERA (M340H-B4GAL-T1) IN COMPLEX WITH PENTASACCHARIDE HOMO SAPIENS BETA1 4-GALACTOSYLTRANSFERASE-I; PENTASACCHARIDE; CLOSED CONFORMATION; MUTANT TRANSFERASE
Ref.: OLIGOSACCHARIDE PREFERENCES OF BETA1,4-GALACTOSYLTRANSFERASE-I: CRYSTAL STRUCTURES MET340HIS MUTANT OF HUMAN BETA1,4-GALACTOSYLTRANSFE WITH A PENTASACCHARIDE AND TRISACCHARIDES OF THE N-MOIETY J.MOL.BIOL. V. 353 53 2005
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
DIO C:433;
Invalid;
none;
submit data
88.105 C4 H8 O2 C1COC...
GOL A:415;
B:412;
B:413;
B:414;
B:417;
B:418;
C:416;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
MN A:400;
B:402;
C:404;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
submit data
54.938 Mn [Mn+2...
SO4 A:419;
A:420;
A:421;
A:429;
B:422;
B:424;
B:425;
B:428;
B:430;
B:432;
C:423;
C:426;
C:427;
C:431;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
UDH A:399;
B:401;
C:403;
Valid;
Valid;
Valid;
none;
none;
none;
submit data
503.335 C15 H27 N3 O12 P2 C1=CN...
MAN NAG F:1;
D:1;
Valid;
Valid;
none;
none;
submit data
383.35 n/a O=C(N...
MAN MAN NAG E:1;
Valid;
none;
submit data
529.492 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2AGD 1.9 Å EC: 2.4.1.90 CRYSTAL STRUCTURE OF HUMAN M340H-BETA-1,4-GALACTOSYLTRANSFER I(M340H-B4GAL-T1) IN COMPLEX WITH GLCNAC-BETA1,4-MAN-ALPHA1B ETA-OR HOMO SAPIENS BETA1 4-GALACTOSYLTRANSFERASE-I; TRISACCHARIDE; CLOSED CONFMUTANT TRANSFERASE
Ref.: OLIGOSACCHARIDE PREFERENCES OF BETA1,4-GALACTOSYLTRANSFERASE-I: CRYSTAL STRUCTURES MET340HIS MUTANT OF HUMAN BETA1,4-GALACTOSYLTRANSFE WITH A PENTASACCHARIDE AND TRISACCHARIDES OF THE N-MOIETY J.MOL.BIOL. V. 353 53 2005
Members (13)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2AGD - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
2 2AE7 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
3 2AEC - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
4 2AES - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
5 2FYB - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
6 1TVY - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
7 2AH9 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
8 3EE5 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
9 1O0R - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
10 1FR8 - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
11 4KRV - NGS C8 H15 N O9 S CC(=O)N[C@....
12 1TW1 - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
13 1TW5 - UDH C15 H27 N3 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 2AGD - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
2 2AE7 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
3 2AEC - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
4 2AES - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
5 2FYB - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
6 1TVY - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
7 2AH9 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
8 3EE5 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
9 1O0R - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
10 1FR8 - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
11 4KRV - NGS C8 H15 N O9 S CC(=O)N[C@....
12 1TW1 - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
13 1TW5 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
14 1FGX - U5P C9 H13 N2 O9 P C1=CN(C(=O....
50% Homology Family (19)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2AGD - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
2 2AE7 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
3 2AEC - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
4 2AES - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
5 2FYB - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
6 1TVY - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
7 2AH9 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
8 3EE5 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
9 1O0R - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
10 1FR8 - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
11 4KRV - NGS C8 H15 N O9 S CC(=O)N[C@....
12 1TW1 - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
13 1TW5 - UDH C15 H27 N3 O12 P2 C1=CN(C(=O....
14 1FGX - U5P C9 H13 N2 O9 P C1=CN(C(=O....
15 4LW3 - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
16 4LW6 - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
17 3LW6 - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
18 4M4K - GDU C15 H24 N2 O17 P2 C1=CN(C(=O....
19 4IRP - UDP C9 H14 N2 O12 P2 C1=CN(C(=O....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: UDH; Similar ligands found: 88
No: Ligand ECFP6 Tc MDL keys Tc
1 UDH 1 1
2 UDP 0.705128 0.864865
3 UTP 0.7 0.864865
4 U5F 0.691358 0.864865
5 UNP 0.654762 0.842105
6 UPP 0.640449 0.842105
7 U 0.628205 0.851351
8 U5P 0.628205 0.851351
9 UFM 0.615385 0.866667
10 UPG 0.615385 0.866667
11 GDU 0.615385 0.866667
12 AWU 0.608696 0.842105
13 44P 0.604938 0.88
14 UPU 0.602273 0.864865
15 URM 0.597826 0.905405
16 660 0.597826 0.905405
17 UPF 0.595745 0.822785
18 UFG 0.595745 0.822785
19 UDX 0.595745 0.866667
20 UAD 0.595745 0.866667
21 U2F 0.595745 0.822785
22 G3N 0.59375 0.893333
23 USQ 0.583333 0.764706
24 UDP UDP 0.583333 0.837838
25 UGA 0.583333 0.853333
26 UGB 0.583333 0.853333
27 UGF 0.57732 0.810127
28 2KH 0.574713 0.842105
29 3UC 0.571429 0.822785
30 F5P 0.552381 0.844156
31 UD4 0.552381 0.844156
32 UD1 0.543689 0.855263
33 UD2 0.543689 0.855263
34 MJZ 0.542857 0.844156
35 UDM 0.539216 0.893333
36 F5G 0.537736 0.831169
37 HP7 0.533333 0.842105
38 UD7 0.533333 0.831169
39 Y6W 0.525773 0.945946
40 HWU 0.523364 0.833333
41 12V 0.523364 0.833333
42 UP5 0.518182 0.792683
43 IUG 0.513761 0.735632
44 UDZ 0.504505 0.814815
45 EEB 0.504425 0.833333
46 URI 0.5 0.794521
47 UDP GAL 0.5 0.842105
48 4TC 0.495575 0.795181
49 EPZ 0.495575 0.844156
50 EPU 0.491228 0.833333
51 U20 0.472 0.864198
52 U21 0.472 0.864198
53 U22 0.472 0.865854
54 UMA 0.471074 0.844156
55 CSQ 0.46729 0.8125
56 CSV 0.46729 0.8125
57 CJB 0.463415 0.756757
58 FZK 0.459184 0.788235
59 CTP 0.452632 0.844156
60 HF4 0.452632 0.844156
61 CDP 0.451613 0.844156
62 0RC 0.44898 0.921053
63 U3P 0.448276 0.837838
64 UA3 0.448276 0.837838
65 BUP 0.447917 0.810127
66 2QR 0.44186 0.831325
67 LSU 0.441176 0.730337
68 DUT 0.4375 0.891892
69 C2G 0.435644 0.881579
70 4RA 0.42963 0.752941
71 YSU 0.425926 0.738636
72 DUD 0.425532 0.891892
73 C5G 0.424528 0.846154
74 U4S 0.422222 0.813333
75 UML 0.42069 0.935897
76 7XL 0.42 0.894737
77 CDC 0.419048 0.788235
78 UAG 0.416058 0.871795
79 1AA 0.415929 0.814815
80 U2P 0.41573 0.851351
81 PUP 0.415094 0.891892
82 CDM 0.415094 0.85
83 UD0 0.413043 0.744186
84 U2S 0.413043 0.826667
85 U3S 0.413043 0.813333
86 5GW 0.411765 0.820513
87 U1S 0.405941 0.807692
88 UTP U U U 0.4 0.8
Ligand no: 2; Ligand: MAN NAG; Similar ligands found: 127
No: Ligand ECFP6 Tc MDL keys Tc
1 MAN NAG 1 1
2 MAN NAG GAL 0.69697 1
3 A2G NAG 0.650794 0.9375
4 GDL NAG 0.650794 0.9375
5 MBG NAG 0.625 0.957447
6 MBG A2G 0.615385 0.957447
7 NDG NAG NAG NAG NAG 0.61194 0.918367
8 NAG NAG NAG NAG NAG NAG 0.61194 0.918367
9 NAG NAG NAG NAG NAG NAG NAG NAG 0.61194 0.918367
10 NAG NAG NAG NAG NAG 0.61194 0.918367
11 BGC GAL NGA 0.608696 1
12 GAL NGA 0.606061 0.93617
13 NDG NAG 0.606061 0.918367
14 GAL FUC A2G 0.605634 0.978261
15 BGC GAL NAG 0.597222 1
16 GAL NGA A2G 0.594203 0.9375
17 MMA MAN NAG 0.591549 0.957447
18 BMA MAN NAG 0.583333 1
19 MAN MAN NAG 0.575342 0.957447
20 NAG GAL NAG 0.575342 0.9375
21 MAG 0.568965 0.893617
22 2F8 0.568965 0.893617
23 AMU NAG 0.56 0.9
24 BGC GAL GLA NGA 0.558442 1
25 3QL 0.541667 0.865385
26 AH0 NAG 0.539474 0.833333
27 MAN MAN MAN NAG NAG 0.5375 0.9375
28 NAG NAG NAG NAG 0.533333 0.849057
29 NAG NAG NAG NAG NAG NAG NAG 0.533333 0.849057
30 NAG NAG NAG 0.533333 0.849057
31 NG1 0.532258 0.75
32 GN1 0.532258 0.75
33 BMA Z4Y NAG 0.525 0.978261
34 NAG NAG BMA MAN NAG 0.52381 0.918367
35 NAG NGO 0.52 0.849057
36 NM9 NAG 0.513158 0.882353
37 BM3 0.508772 0.888889
38 A2G 0.508772 0.888889
39 HSQ 0.508772 0.888889
40 NDG 0.508772 0.888889
41 NGA 0.508772 0.888889
42 NAG 0.508772 0.888889
43 NGT NAG 0.506494 0.775862
44 NAG NOJ NAG 0.506329 0.818182
45 NAG NOJ NAG NAG 0.506329 0.803571
46 NAG AH0 0.506173 0.833333
47 BGC FUC GAL NAG 0.506024 0.978261
48 GAL NAG 0.5 1
49 NAG BDP NAG BDP NAG BDP NAG 0.5 0.9
50 Z3Q NGA 0.5 0.762712
51 BGC GAL FUC A2G 0.494118 0.978261
52 MA8 0.492958 0.843137
53 TNR 0.492754 0.86
54 3YW 0.492537 0.913043
55 MMA MAN NAG MAN NAG NAG 0.488095 0.9
56 6Y2 0.487805 0.703125
57 LEC NGA 0.487805 0.703125
58 Z4S NAG NAG 0.4875 0.849057
59 BGC FUC GAL FUC A2G 0.482353 0.957447
60 NAG GAL GLC NAG GLC RAM 0.481928 0.9375
61 SN5 SN5 0.478873 0.803922
62 SER A2G 0.471429 0.843137
63 GYU 0.471429 0.767857
64 AMV NAG AMU NAG 0.470588 0.882353
65 NAG NGT NAG 0.46988 0.762712
66 GAL NAG GAL 0.467532 1
67 NAG GAL FUC FUC A2G 0.465909 0.918367
68 NAG FUC GAL FUC A2G 0.465909 0.918367
69 A2G GAL 0.463768 1
70 NAG GAL 0.463768 1
71 A2G GAL NAG 0.4625 0.9375
72 BMA MAN MAN NAG GAL NAG 0.462366 0.9375
73 YZ0 MAN MAN NAG MAN 0.460674 0.957447
74 NAG GAL NAG GAL 0.45679 0.9375
75 GAL NAG GAL NAG GAL 0.45679 0.9375
76 NAG GAL NAG GAL NAG GAL 0.45679 0.918367
77 FHY 0.453488 0.849057
78 LEC 0.453333 0.68254
79 6ZC 0.453333 0.68254
80 NAG NAG NAG TMX 0.45 0.775862
81 NDG BMA MAN MAN NAG GAL NAG 0.44898 0.918367
82 GYP GZL NAG 0.448276 0.9
83 HSH A2G FUC 0.448276 0.818182
84 BGC GAL NAG GAL 0.444444 1
85 NAG NAG BMA MAN MAN NAG GAL NAG 0.444444 0.918367
86 NDG BMA MAN MAN NAG MAN MAN 0.444444 0.9375
87 GLC GAL NAG GAL FUC A2G 0.443299 0.918367
88 MAN MAN MAN GLC 0.438356 0.733333
89 NAA AMI NAA 0.438202 0.692308
90 AO3 0.438202 0.692308
91 BMX BMX BMX BM3 0.4375 0.789474
92 BGC GAL NGA GAL 0.4375 1
93 GAL SIA NGA 0.43299 0.865385
94 NAG GAL FUC A2G 0.43038 0.978261
95 57S 0.43038 0.741379
96 NAG GAL GAL 0.428571 1
97 GUM 0.428571 0.803571
98 NAG NAG BMA 0.426829 0.865385
99 ALA NAG AH0 DAL 0.425532 0.818182
100 NAG GAL FUC 0.425 0.978261
101 GLA NAG GAL FUC 0.423529 0.978261
102 BGC GAL GLA NGA GAL 0.423529 1
103 GYT 0.423077 0.762712
104 TVD GAL 0.422535 0.918367
105 MGC GAL 0.422535 0.957447
106 NAG NAG BMA MAN MAN NAG NAG 0.421569 0.849057
107 UMG 0.419355 0.803571
108 AMU ALA NAG DGL 0.418367 0.833333
109 HD4 0.417722 0.741379
110 NAG GAL BGC GAL 0.414634 1
111 NAG GAL FUC FUC 0.414634 0.957447
112 NDG FUC GAL FUC 0.414634 0.957447
113 MUB ALA NAG ZGL 0.414141 0.818182
114 GDL PHJ NAG 0.410526 0.737705
115 NDG NAG GLA NAG GLC RAM 0.41 0.918367
116 MUB ALA NAG DGN 0.41 0.818182
117 BDP NPO NDG BDP NDG 0.41 0.703125
118 NDG GLA NAG GLC RAM 0.41 0.918367
119 MUB ALA NAG GLN 0.41 0.833333
120 BGC GAL NAG NAG GAL GAL 0.408602 0.9375
121 NAG BMA 0.405405 0.897959
122 YX1 0.402985 0.650794
123 GAL 2NA NAG 0.402062 0.882353
124 AHR FUB 0.4 0.638298
125 NAG NAG BMA MAN 0.4 0.865385
126 SNG 0.4 0.816327
127 NAG FUC GAL 0.4 0.978261
Ligand no: 3; Ligand: MAN MAN NAG; Similar ligands found: 99
No: Ligand ECFP6 Tc MDL keys Tc
1 MAN MAN NAG 1 1
2 GAL NGA 0.830769 0.978723
3 GAL NAG GAL FUC 0.670732 0.979167
4 MMA MAN NAG 0.636364 0.918367
5 MAN MAN MAN NAG NAG 0.6 0.9
6 MAN NAG 0.575342 0.957447
7 NAG NAG BMA MAN NAG 0.549451 0.882353
8 NDG NAG 0.545455 0.882353
9 A2G NAG 0.539474 0.9
10 GDL NAG 0.539474 0.9
11 MMA MAN NAG MAN NAG NAG 0.533333 0.865385
12 3QL 0.530864 0.833333
13 NAG NAG NAG 0.52381 0.886792
14 NAG NAG NAG NAG 0.52381 0.886792
15 NAG NAG NAG NAG NAG NAG NAG 0.52381 0.886792
16 YZ0 MAN MAN NAG MAN 0.521277 0.918367
17 BMA MAN MAN NAG GAL NAG 0.520408 0.9
18 MBG NAG 0.519481 0.918367
19 GAL NGA A2G 0.518519 0.9
20 MBG A2G 0.512821 0.918367
21 NAG NAG NAG NAG NAG NAG 0.5125 0.882353
22 NAG NAG NAG NAG NAG 0.5125 0.882353
23 NAG NAG NAG NAG NAG NAG NAG NAG 0.5125 0.882353
24 NDG NAG NAG NAG NAG 0.5125 0.882353
25 BMA MAN NAG 0.511905 0.957447
26 NAG NAG BMA MAN MAN NAG NAG 0.504762 0.886792
27 BMA Z4Y NAG 0.5 0.9375
28 GAL FUC A2G 0.494118 0.9375
29 BGC GAL NGA 0.493976 0.957447
30 NAG GAL NAG 0.488372 0.9
31 BGC GAL NAG 0.488372 0.957447
32 NAG AH0 0.483516 0.803571
33 NAG NOJ NAG 0.483146 0.854545
34 Z4S NAG NAG 0.483146 0.818182
35 NAG NOJ NAG NAG 0.483146 0.839286
36 BGC FUC GAL FUC A2G 0.478723 0.918367
37 AH0 NAG 0.477273 0.803571
38 AMU NAG 0.477273 0.865385
39 NDG BMA MAN MAN NAG GAL NAG 0.47619 0.882353
40 BGC GAL FUC A2G 0.473684 0.9375
41 GLA NAG GAL FUC 0.472527 0.9375
42 NDG BMA MAN MAN NAG MAN MAN 0.471698 0.9
43 NAG NAG BMA MAN MAN NAG GAL NAG 0.471698 0.882353
44 6Y2 0.467391 0.681818
45 LEC NGA 0.467391 0.681818
46 MAG 0.464789 0.857143
47 2F8 0.464789 0.857143
48 BGC GAL GLA NGA 0.461538 0.957447
49 NAG GAL FUC 0.45977 0.9375
50 NM9 NAG 0.454545 0.849057
51 YZ0 MAN Z4Y NAG MAN 0.453704 0.865385
52 BGC FUC GAL NAG 0.452632 0.9375
53 NAG FUC GAL FUC A2G 0.44898 0.882353
54 NAG GAL FUC FUC A2G 0.44898 0.882353
55 NAG GAL FUC A2G 0.448276 0.9375
56 Z3Q NGA 0.444444 0.737705
57 NAG NGO 0.443182 0.818182
58 NG1 0.44 0.724138
59 GN1 0.44 0.724138
60 GAL NAG GAL FUC FUC 0.4375 0.918367
61 AMV NAG AMU NAG 0.4375 0.849057
62 MAN NAG GAL 0.436782 0.957447
63 NGT NAG 0.433333 0.75
64 NDG FUC GAL FUC 0.433333 0.918367
65 NAG GAL FUC FUC 0.433333 0.918367
66 GYP GZL NAG 0.43299 0.901961
67 NAG BDP NAG BDP NAG BDP NAG 0.43299 0.865385
68 GAL NAG GAL 0.431818 0.957447
69 NAG GAL GLC NAG GLC RAM 0.431579 0.9
70 3YW 0.43038 0.914894
71 NAG BMA MAN MAN NAG GAL NAG GAL 0.428571 0.882353
72 NAG NAG BMA 0.428571 0.903846
73 C4W NAG FUC BMA MAN MAN NAG NAG 0.423729 0.833333
74 FHY 0.42268 0.818182
75 GAL NAG 0.421687 0.957447
76 SN5 SN5 0.421687 0.773585
77 NAG NGT NAG 0.421053 0.737705
78 NAG ASN NAG BMA MAN MAN NAG NAG 0.418803 0.821429
79 ALA ASN LYS NAG NAG BMA MAN MAN NAG NAG 0.418803 0.836364
80 6ZC 0.418605 0.661538
81 LEC 0.418605 0.661538
82 HSH A2G FUC 0.418367 0.821429
83 MAG FUC GAL FUC 0.417582 0.9
84 MAG GAL FUC FUC 0.417582 0.9
85 MA8 0.416667 0.846154
86 GLC GAL NAG GAL FUC A2G 0.416667 0.882353
87 NAG NAG BMA MAN MAN MAN MAN 0.415929 0.903846
88 BGC GAL NAG GAL FUC 0.415842 0.9375
89 GYU 0.414634 0.77193
90 SER A2G 0.414634 0.846154
91 XYS GAL FUC 0.413793 0.744681
92 ALA NAG AH0 DAL 0.413462 0.789474
93 C4W NAG FUC BMA MAN NAG 0.412281 0.833333
94 GAL NAG GAL NAG GAL 0.408602 0.9
95 GLA NAG FUC GAL 0.408163 0.958333
96 GAL SIA NGA 0.407407 0.867925
97 GAL 2NA NAG 0.40566 0.849057
98 NAG NAG BMA MAN 0.40404 0.903846
99 GUM 0.401961 0.775862
Similar Ligands (3D)
Ligand no: 1; Ligand: UDH; Similar ligands found: 0
No: Ligand Similarity coefficient
Ligand no: 2; Ligand: MAN NAG; Similar ligands found: 2
No: Ligand Similarity coefficient
1 SN5 NGT 0.8764
2 GLA GLC 0.8580
Ligand no: 3; Ligand: MAN MAN NAG; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2AGD; Ligand: BMA MAN NAG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 2agd.bio3) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2AGD; Ligand: UDH; 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: 2agd.bio3) has 31 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 2AGD; Ligand: UDH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 2agd.bio1) has 29 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 2AGD; Ligand: UDH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 2agd.bio2) has 20 residues
No: Leader PDB Ligand Sequence Similarity
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