Receptor
PDB id Resolution Class Description Source Keywords
5T55 1.43 Å NON-ENZYME: BINDING LECTIN FROM BAUHINIA FORFICATA IN COMPLEX WITH GLOBOTETRAOSE BAUHINIA FORFICATA LEGUME LECTIN CONCANAVALIN A GALNAC-SPECIFIC LIGAND-FREEBINDING PROTEIN
Ref.: STRUCTURAL ANALYSIS AND UNIQUE MOLECULAR RECOGNITIO PROPERTIES OF A BAUHINIA FORFICATA LECTIN THAT INHI CANCER CELL GROWTH. FEBS J. V. 284 429 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:301;
B:302;
B:301;
A:302;
 Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
 none;
none;
none;
none;
 submit data
40.078 Ca [Ca+2...
EDO A:310;
A:307;
B:307;
A:311;
B:309;
B:308;
A:308;
A:309;
A:305;
A:306;
 Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
 none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
 submit data
62.068 C2 H6 O2 C(CO)...
CL B:310;
 Invalid;
 none;
 submit data
35.453 Cl [Cl-]
GAL NGA C:1;
 Valid;
 Atoms found LESS than expected: % Diff = 0.038;
 submit data
367.351 n/a O=C(N...
BGC GAL GLA NGA D:1;
 Valid;
 none;
 Kd = 0.68 nM
707.632 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5T52 1.7 Å NON-ENZYME: BINDING LECTIN FROM BAUHINIA FORFICATA IN COMPLEX WITH GALNAC BAUHINIA FORFICATA LEGUME LECTIN CONCANAVALIN A GALNAC-SPECIFIC LIGAND-FREEBINDING PROTEIN
Ref.: STRUCTURAL ANALYSIS AND UNIQUE MOLECULAR RECOGNITIO PROPERTIES OF A BAUHINIA FORFICATA LECTIN THAT INHI CANCER CELL GROWTH. FEBS J. V. 284 429 2017
Members (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 552 families.
1 5T55 Kd = 0.68 nM BGC GAL GLA NGA n/a n/a
2 5T54 Kd = 0.87 nM GLA FUC A2G n/a n/a
3 5T5J Kd = 0.73 nM ACA SER SER VAL GLY A2G n/a n/a
4 5T52 Kd = 0.54 nM NGA C8 H15 N O6 CC(=O)N[C@....
5 5T5L Kd = 0.73 nM ACE SER SER VAL GLY A2G n/a n/a
6 5T5P Kd = 0.71 nM ACE SER THR VAL GLY A2G n/a n/a
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 426 families.
1 5T55 Kd = 0.68 nM BGC GAL GLA NGA n/a n/a
2 5T54 Kd = 0.87 nM GLA FUC A2G n/a n/a
3 5T5J Kd = 0.73 nM ACA SER SER VAL GLY A2G n/a n/a
4 5T52 Kd = 0.54 nM NGA C8 H15 N O6 CC(=O)N[C@....
5 5T5L Kd = 0.73 nM ACE SER SER VAL GLY A2G n/a n/a
6 5T5P Kd = 0.71 nM ACE SER THR VAL GLY A2G n/a n/a
50% Homology Family (67)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 322 families.
1 5T55 Kd = 0.68 nM BGC GAL GLA NGA n/a n/a
2 5T54 Kd = 0.87 nM GLA FUC A2G n/a n/a
3 5T5J Kd = 0.73 nM ACA SER SER VAL GLY A2G n/a n/a
4 5T52 Kd = 0.54 nM NGA C8 H15 N O6 CC(=O)N[C@....
5 5T5L Kd = 0.73 nM ACE SER SER VAL GLY A2G n/a n/a
6 5T5P Kd = 0.71 nM ACE SER THR VAL GLY A2G n/a n/a
7 1FNZ - A2G C8 H15 N O6 CC(=O)N[C@....
8 1S1A - MMA MAN n/a n/a
9 2ARB Ka = 26000 M^-1 MAN NAG n/a n/a
10 1N3Q - FRU GLC n/a n/a
11 2AR6 Ka = 63000 M^-1 MAN MAN MAN NAG NAG n/a n/a
12 1N3O - GYP C7 H14 O6 CO[C@@H]1[....
13 1N3P - GLC FRU n/a n/a
14 2ARX - MAN MAN n/a n/a
15 2ARE Ka = 1900 M^-1 MAN C6 H12 O6 C([C@@H]1[....
16 1LED - MAG GAL FUC FUC n/a n/a
17 1GSL - MAG FUC GAL FUC n/a n/a
18 1V00 - BGC GAL n/a n/a
19 3N3H - CIT C6 H8 O7 C(C(=O)O)C....
20 3N36 - GLA C6 H12 O6 C([C@@H]1[....
21 1AX0 Ka = 1340 M^-1 A2G C8 H15 N O6 CC(=O)N[C@....
22 1UZY - BGC GAL n/a n/a
23 1LTE - BGC GAL n/a n/a
24 1AX1 Ka = 1940 M^-1 BGC GAL n/a n/a
25 1AX2 Ka = 9730 M^-1 NDG GAL n/a n/a
26 1GZC Kd = 0.32 mM BGC GAL n/a n/a
27 3N35 - A2G C8 H15 N O6 CC(=O)N[C@....
28 1AXZ Ka = 1570 M^-1 GAL C6 H12 O6 C([C@@H]1[....
29 1GZ9 Kd = 0.31 mM BGC GAL FUC n/a n/a
30 3ZYR Kd = 4.6 uM NAG ASN NAG BMA MAN MAN NAG NAG n/a n/a
31 3ZVX - MAN MAN MAN n/a n/a
32 5U38 - MMA MAN n/a n/a
33 5KXE Kd = 5.45 uM 6Y2 C22 H31 N3 O13 CC(=O)N[C@....
34 5KXB - NGA C8 H15 N O6 CC(=O)N[C@....
35 5KXC - 6Y2 C22 H31 N3 O13 CC(=O)N[C@....
36 5KXD - 6Y2 C22 H31 N3 O13 CC(=O)N[C@....
37 4WV8 - GLC GAL n/a n/a
38 4U2A - A2G C8 H15 N O6 CC(=O)N[C@....
39 4U36 - SER A2G n/a n/a
40 1JXN - MFU C7 H14 O5 C[C@H]1[C@....
41 3WCS - MAN NAG GAL n/a n/a
42 3WOG - MAN NAG n/a n/a
43 5EYX - MMA MAN n/a n/a
44 5EYY - MMA MAN n/a n/a
45 2BQP - GLC C6 H12 O6 C([C@@H]1[....
46 5T7P - XMM C14 H15 Br Cl N O6 c1cc(c(c2c....
47 2DVA - MGC GAL n/a n/a
48 6VC4 Kd = 360 uM QWG C22 H37 N3 O14 S2 CO[C@@H]1[....
49 6VGF Kd = 180 uM WA3 C42 H68 N6 O27 S4 c1c(nnn1C[....
50 2DV9 - GAL GAL n/a n/a
51 1V6K - GLC GAL n/a n/a
52 1V6L - BGC GAL n/a n/a
53 2DVD - GAL GAL n/a n/a
54 6VC3 Kd = 482 uM QWJ C15 H24 O9 S2 C#CCSC[C@@....
55 2TEP - NGA GAL n/a n/a
56 6V95 Kd = 495 uM QSG C32 H48 N10 O20 c1c(nnn1[C....
57 6VAV Kd = 690 uM QTY C32 H48 N10 O16 c1c(nnn1[C....
58 2DVB - GAL C6 H12 O6 C([C@@H]1[....
59 1V6I - GLC GAL n/a n/a
60 6VAW Kd = 1563 uM S3W C20 H33 N5 O12 CO[C@@H]1[....
61 2PEL Ki = 1.37 mM BGC GAL n/a n/a
62 1G9F - GAL NAG GAL NAG GAL n/a n/a
63 2DTW - 2GS C7 H14 O6 CO[C@@H]1[....
64 1WBL - AMG C7 H14 O6 CO[C@@H]1[....
65 2ZMK - EGA GLA n/a n/a
66 2D3S - SER A2G n/a n/a
67 2FMD - MAN MAN n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: GAL NGA; Similar ligands found: 106
No: Ligand ECFP6 Tc MDL keys Tc
1 GAL NGA 1 1
2 MAN MAN NAG 0.830769 0.978723
3 A2G NAG 0.61194 0.88
4 MAN NAG 0.606061 0.93617
5 GAL NAG GAL FUC 0.6 0.958333
6 GDL NAG 0.588235 0.88
7 MBG NAG 0.588235 0.897959
8 GAL NGA A2G 0.583333 0.88
9 3QL 0.575342 0.814815
10 NAG NAG NAG 0.565789 0.867925
11 NAG NAG NAG NAG 0.565789 0.867925
12 NAG NAG NAG NAG NAG NAG NAG 0.565789 0.867925
13 MBG A2G 0.557143 0.897959
14 NAG NAG NAG NAG NAG 0.555556 0.862745
15 NAG NAG NAG NAG NAG NAG 0.555556 0.862745
16 NAG NAG NAG NAG NAG NAG NAG NAG 0.555556 0.862745
17 NDG NAG NAG NAG NAG 0.555556 0.862745
18 BMA MAN NAG 0.552632 0.93617
19 NDG NAG 0.549296 0.862745
20 BGC GAL NGA 0.533333 0.93617
21 GAL FUC A2G 0.532468 0.916667
22 MAG 0.532258 0.875
23 2F8 0.532258 0.875
24 AH0 NAG 0.531646 0.785714
25 NAG GAL NAG 0.525641 0.88
26 BGC GAL NAG 0.525641 0.93617
27 MMA MAN NAG 0.519481 0.897959
28 NAG NOJ NAG 0.518519 0.836364
29 NAG NOJ NAG NAG 0.518519 0.821429
30 Z4S NAG NAG 0.518519 0.8
31 NG1 0.5 0.706897
32 NAG AH0 0.5 0.785714
33 LEC NGA 0.5 0.666667
34 GN1 0.5 0.706897
35 MAN MAN MAN NAG NAG 0.494118 0.88
36 BGC GAL GLA NGA 0.493976 0.93617
37 AMU NAG 0.493827 0.846154
38 NAG NGO 0.493671 0.8
39 NM9 NAG 0.4875 0.830189
40 3YW 0.485714 0.934783
41 BGC FUC GAL NAG 0.482759 0.916667
42 6Y2 0.482353 0.666667
43 NGT NAG 0.481481 0.733333
44 BGC FUC GAL FUC A2G 0.477273 0.897959
45 NAG GAL GLC NAG GLC RAM 0.476744 0.88
46 Z3Q NGA 0.47561 0.721311
47 FHY 0.465909 0.8
48 GYU 0.465753 0.754386
49 SER A2G 0.465753 0.826923
50 BMA Z4Y NAG 0.465116 0.916667
51 GAL NAG GAL 0.4625 0.93617
52 NAG BDP NAG BDP NAG BDP NAG 0.460674 0.846154
53 NAG NAG BMA 0.457831 0.884615
54 BGC GAL FUC A2G 0.455556 0.916667
55 GAL NAG 0.453333 0.93617
56 SN5 SN5 0.453333 0.754717
57 NAG NAG BMA MAN NAG 0.450549 0.862745
58 GLA NAG FUC GAL 0.449438 0.9375
59 LEC 0.448718 0.646154
60 6ZC 0.448718 0.646154
61 NAG NGT NAG 0.448276 0.721311
62 MA8 0.447368 0.826923
63 TNR 0.445946 0.843137
64 NAG FUC GAL FUC A2G 0.445652 0.862745
65 NAG GAL FUC FUC A2G 0.445652 0.862745
66 HSH A2G FUC 0.444444 0.803571
67 GYP GZL NAG 0.444444 0.882353
68 A2G GAL NAG 0.440476 0.88
69 NAG BMA 0.44 0.958333
70 A2G GAL 0.438356 0.93617
71 ALA NAG AH0 DAL 0.4375 0.77193
72 GAL NAG GAL NAG GAL 0.435294 0.88
73 MMA MAN NAG MAN NAG NAG 0.433333 0.846154
74 AMV NAG AMU NAG 0.433333 0.830189
75 MAN NAG GAL 0.432099 0.93617
76 HD4 0.432099 0.728814
77 GAL SIA NGA 0.43 0.849057
78 A2G 0.428571 0.869565
79 NGA 0.428571 0.869565
80 NAG NAG BMA MAN 0.428571 0.884615
81 HSQ 0.428571 0.869565
82 BMA MAN MAN NAG GAL NAG 0.428571 0.88
83 GAL 2NA NAG 0.428571 0.830189
84 NAG 0.428571 0.869565
85 NDG 0.428571 0.869565
86 BM3 0.428571 0.869565
87 57S 0.426829 0.728814
88 GUM 0.425532 0.758621
89 YZ0 MAN MAN NAG MAN 0.425532 0.897959
90 MAN MAN BMA 0.421053 0.723404
91 GYT 0.419753 0.779661
92 AO3 0.419355 0.656716
93 NAA AMI NAA 0.419355 0.656716
94 NAG NAG BMA MAN MAN NAG NAG 0.419048 0.867925
95 MGC GAL 0.418919 0.897959
96 NAG GAL 0.418919 0.93617
97 NAG GAL NAG GAL 0.418605 0.88
98 NAG GAL NAG GAL NAG GAL 0.418605 0.862745
99 UMG 0.416667 0.758621
100 BMX BMX BMX BM3 0.416667 0.745763
101 NAG NAG BMA BMA 0.41573 0.851852
102 NAG NAG NAG TMX 0.411765 0.733333
103 GDL PHJ NAG 0.408163 0.698413
104 AMU ALA NAG DGL 0.401961 0.818182
105 TVD GAL 0.4 0.862745
106 BGC GAL NGA GAL 0.4 0.93617
Ligand no: 2; Ligand: BGC GAL GLA NGA; Similar ligands found: 186
No: Ligand ECFP6 Tc MDL keys Tc
1 BGC GAL GLA NGA 1 1
2 BGC GAL NAG 0.927536 1
3 BGC GAL NGA 0.842857 1
4 BGC GAL GLA NGA GAL 0.805195 1
5 BGC GAL NAG GAL 0.753247 1
6 BMA MAN NAG 0.736842 1
7 NAG GAL NAG 0.727273 0.9375
8 BGC GAL NGA GAL 0.705128 1
9 GLC GAL NAG GAL FUC A2G 0.698925 0.918367
10 BGC BGC BGC BGC BGC BGC BGC BGC 0.694444 0.733333
11 GAL NAG GAL NAG GAL 0.679012 0.9375
12 BGC FUC GAL NAG 0.662791 0.978261
13 NAG GAL NAG GAL 0.658537 0.9375
14 NAG GAL NAG GAL NAG GAL 0.658537 0.918367
15 BGC GAL NAG NAG GAL GAL 0.655556 0.9375
16 BGC GAL NAG GAL FUC 0.644444 0.978261
17 NAG NAG BMA MAN NAG 0.640449 0.918367
18 BGC GAL GLA 0.638889 0.733333
19 BGC GAL FUC A2G 0.629214 0.978261
20 GAL NAG GAL 0.617284 1
21 GLC GAL NAG GAL FUC GLA 0.610526 0.978261
22 MBG NAG 0.605263 0.957447
23 BGC FUC GAL NAG GAL 0.602151 0.978261
24 NAG GAL GAL 0.6 1
25 BGC GAL NAG GAL FUC FUC 0.6 0.957447
26 GAL NGA A2G 0.6 0.9375
27 MBG A2G 0.597403 0.957447
28 GLC GLC GLC GLC BGC GLC GLC 0.591549 0.733333
29 MAN BMA BMA BMA BMA BMA BMA 0.591549 0.733333
30 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.591549 0.733333
31 GDL NAG 0.564103 0.9375
32 MAN NAG 0.558442 1
33 NAG NAG NAG NAG NAG 0.555556 0.918367
34 NAG NAG NAG NAG NAG NAG 0.555556 0.918367
35 NDG NAG NAG NAG NAG 0.555556 0.918367
36 NAG NAG NAG NAG NAG NAG NAG NAG 0.555556 0.918367
37 NDG BMA MAN MAN NAG GAL NAG 0.553398 0.918367
38 NAG NAG BMA MAN 0.548387 0.865385
39 NAG NAG BMA MAN MAN NAG GAL NAG 0.548077 0.918367
40 MAN NAG GAL 0.547619 1
41 MMA MAN NAG 0.541176 0.957447
42 BMA MAN MAN NAG GAL NAG 0.54 0.9375
43 NDG BMA MAN MAN NAG MAN MAN 0.533333 0.9375
44 BGC GAL GLA NGA GAL SIA 0.526316 0.865385
45 A2G NAG 0.525 0.9375
46 BMA BMA BMA BMA 0.525 0.733333
47 NAG NAG MAN MAN MAN 0.520408 0.9375
48 BGC GAL NAG GAL SIA 0.517241 0.849057
49 BGC FUC GAL FUC A2G 0.515789 0.957447
50 BGC GAL SIA NAG 0.508929 0.865385
51 NAG GAL 0.506329 1
52 NAG BMA MAN MAN NAG GAL NAG GAL 0.504854 0.918367
53 GAL FUC A2G 0.5 0.978261
54 BMA BMA BMA BMA GLA 0.494118 0.733333
55 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.494118 0.733333
56 GAL NGA 0.493976 0.93617
57 NAG GAL BGC GAL 0.488889 1
58 NAG BDP NAG BDP NAG BDP NAG 0.484536 0.9
59 MAN MAN MAN NAG NAG 0.484211 0.9375
60 BGC GLC GLC GLC 0.482353 0.733333
61 GLC GLC GLC GLC GLC 0.482353 0.733333
62 BGC BGC BGC BGC BGC BGC BGC 0.480519 0.733333
63 GLC BGC BGC BGC 0.480519 0.733333
64 BGC BGC BGC BGC BGC BGC 0.480519 0.733333
65 BGC BGC BGC 0.480519 0.733333
66 BGC BGC BGC BGC BGC 0.480519 0.733333
67 NAG NAG NAG NAG 0.477778 0.849057
68 NAG NAG NAG NAG NAG NAG NAG 0.477778 0.849057
69 NAG NAG NAG 0.477778 0.849057
70 C4W NAG FUC BMA MAN 0.476636 0.865385
71 NDG NAG 0.47619 0.918367
72 BMA Z4Y NAG 0.473684 0.978261
73 NAG NAG BMA MAN MAN MAN MAN MAN MAN MAN 0.468468 0.9375
74 NAG NAG BMA MAN MAN NAG NAG 0.468468 0.849057
75 NAG NAG BMA 0.467391 0.865385
76 Z3Q NGA 0.467391 0.762712
77 AMU NAG 0.467391 0.9
78 GLC GLC AC1 0.463415 0.851064
79 GAL NAG FUC GAL 0.463158 0.978261
80 GLA NAG GAL FUC 0.463158 0.978261
81 MAN MAN NAG 0.461538 0.957447
82 NAG BMA MAN MAN MAN MAN 0.46 1
83 BGC GLA GAL 0.459459 0.733333
84 C4W NAG FUC BMA MAN MAN NAG 0.458333 0.865385
85 ARE 0.456311 0.836735
86 AAO 0.456311 0.836735
87 NAG FUC GAL FUC A2G 0.455446 0.918367
88 NAG GAL FUC FUC A2G 0.455446 0.918367
89 BGC GAL SIA NGA SIA 0.452381 0.849057
90 A2G GAL NAG 0.451613 0.9375
91 TVD GAL 0.451219 0.918367
92 A2G GAL 0.451219 1
93 G2F SHG BGC BGC 0.451219 0.673469
94 NAG NGO 0.450549 0.849057
95 BGC GAL FUC GLA 0.450549 0.755556
96 BGC GAL SIA NGA GAL 0.45 0.865385
97 BGC GLC AGL GLC GLC GLC 0.447917 0.93617
98 TXT 0.447917 0.87234
99 NAG BMA MAN MAN MAN MAN MAN MAN MAN 0.447619 1
100 C4W NAG FUC BMA MAN MAN NAG GAL NAG 0.447154 0.775862
101 GAL NAG 0.447059 1
102 SN5 SN5 0.447059 0.803922
103 GLC GAL EMB GAL MEC 0.446602 0.75
104 G4D G4D G4D G4D G4D G4D G4D G4D G4D G4D G4D 0.445783 0.717391
105 1GN ACY GAL 1GN BGC ACY GAL BGC 0.445545 0.9375
106 NDG NAG GLA NAG GLC RAM 0.445455 0.918367
107 NDG GLA NAG GLC RAM 0.445455 0.918367
108 NAG BMA MAN MAN MAN MAN MAN MAN MAN MAN 0.443396 1
109 NAG NAG BMA BMA 0.443299 0.833333
110 BGC BGC BGC BGC BGC XYS 0.442105 0.702128
111 BGC BGC BGC XYS BGC XYS BGC XYS BGC 0.442105 0.702128
112 Z4S NAG NAG 0.442105 0.849057
113 NAG NOJ NAG NAG 0.442105 0.803571
114 BGC BGC BGC BGC XYS BGC XYS BGC BGC 0.442105 0.702128
115 NAG NOJ NAG 0.442105 0.818182
116 BGC GAL FUC 0.44186 0.755556
117 GLC GAL BGC FUC 0.44186 0.755556
118 C4W NAG FUC BMA MAN MAN NAG NAG 0.441667 0.865385
119 NGT NAG 0.44086 0.775862
120 NAG NAG NAG TMX 0.44086 0.775862
121 GAL 2NA NAG 0.439252 0.882353
122 YZ0 MAN MAN NAG MAN 0.436893 0.957447
123 GUM 0.436893 0.803571
124 AH0 NAG 0.43617 0.833333
125 BGC GLC GLC 0.435294 0.733333
126 NAG NAG BMA MAN MAN MAN MAN 0.434783 0.865385
127 NAG GAL NAG GAL SIA 0.434426 0.849057
128 2F8 0.434211 0.893617
129 MAG 0.434211 0.893617
130 MGC GAL 0.433735 0.957447
131 MAN BMA BMA 0.433735 0.702128
132 NDG GLA GLC NAG GLC RAM 0.433628 0.918367
133 3QL 0.433333 0.865385
134 BGC BGC BGC XYS 0.430108 0.702128
135 NM9 NAG 0.430108 0.882353
136 GAL NAG GAL FUC FUC 0.43 0.957447
137 AMV NAG AMU NAG 0.43 0.882353
138 NAG NGT NAG 0.428571 0.762712
139 6Y2 0.428571 0.703125
140 UMG 0.428571 0.803571
141 MAN MAN M6P 0.426966 0.611111
142 GAL NGA GAL SIA 0.426087 0.865385
143 HSH A2G FUC 0.425743 0.818182
144 MA8 0.425287 0.843137
145 ALA ASN LYS NAG NAG BMA MAN MAN NAG NAG 0.425 0.833333
146 NAG ASN NAG BMA MAN MAN NAG NAG 0.425 0.818182
147 NAG GAL GLC NAG GLC RAM 0.424242 0.9375
148 MGL GAL 0.423077 0.73913
149 MAN NAG PO4 NGA PO4 0.42268 0.789474
150 GAL GLC GLD ACI 0.42268 0.836735
151 BGC BGC BGC XYS BGC XYS 0.421053 0.702128
152 BDP NPO NDG BDP NDG 0.419643 0.703125
153 NAG BMA 0.418605 0.897959
154 BGC GAL SIA NGA GAL SIA 0.418033 0.865385
155 AO3 0.417476 0.692308
156 GLC GLC GLC G6D ACI GLC GLC 0.417476 0.836735
157 QV4 0.417476 0.836735
158 NAA AMI NAA 0.417476 0.692308
159 BGC 5VQ GAL GLA 0.416667 0.708333
160 GAL GLA 0.415584 0.733333
161 GLC GLC G6D GLC ACI GLC 0.415094 0.803922
162 GLC GLC AC1 GLC GLC GLC 0.415094 0.803922
163 GLC GLC AGL HMC GLC 0.415094 0.803922
164 NAG GAL FUC GLA 0.414141 0.978261
165 LEC NGA 0.414141 0.703125
166 MAN MAN MAN GLC 0.413793 0.733333
167 NAG NAG FUL BMA MAN MAN NAG GAL 0.413223 0.849057
168 GN1 0.4125 0.75
169 NG1 0.4125 0.75
170 ACG 0.411215 0.8
171 BGC XGP 0.409639 0.611111
172 NAG GAL FUC A2G 0.408602 0.978261
173 NAG G6S 0.408602 0.725806
174 7SA 0.407407 0.803922
175 C4W NAG FUC BMA MAN NAG 0.40678 0.865385
176 BGC BGC BGC BGC 0.406593 0.733333
177 C4W NAG FUC BMA 0.40566 0.865385
178 MBG GAL 0.405063 0.73913
179 3YW 0.404762 0.913043
180 GLC NBU GAL GLA 0.402299 0.68
181 G2F BGC BGC BGC BGC BGC 0.402299 0.66
182 MMA MAN NAG MAN NAG NAG 0.401961 0.9
183 GAL SIA NGA 0.401786 0.865385
184 BGC GAL SIA 0.401786 0.882353
185 BGC GAL SIA NGA GAL FUC 0.401515 0.865385
186 NAG AH0 0.4 0.833333
Similar Ligands (3D)
Ligand no: 1; Ligand: GAL NGA; Similar ligands found: 6
No: Ligand Similarity coefficient
1 NGA NAG 0.8881
2 MBG GAL 0.8857
3 NAG NAG 0.8823
4 GAL GAL 0.8811
5 NAG GCD 0.8802
6 BGC BGC 0.8794
Ligand no: 2; Ligand: BGC GAL GLA NGA; 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 : 5T52; Ligand: NGA; 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: 5t52.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5T52; Ligand: A2G; 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: 5t52.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback