Receptor
PDB id Resolution Class Description Source Keywords
2EAL 1.85 Å NON-ENZYME: BINDING CRYSTAL STRUCTURE OF HUMAN GALECTIN-9 N-TERMINAL CRD IN COMP FORSSMAN PENTASACCHARIDE HOMO SAPIENS BETA SANDWICH CARBOHYDRATE BINDING PROTEIN GALECTIN SUGARPROTEIN
Ref.: STRUCTURAL ANALYSIS OF THE HUMAN GALECTIN-9 N-TERMI CARBOHYDRATE RECOGNITION DOMAIN REVEALS UNEXPECTED PROPERTIES THAT DIFFER FROM THE MOUSE ORTHOLOGUE. J.MOL.BIOL. V. 375 119 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GAL NGA A2G A:149;
B:149;
Valid;
Valid;
none;
none;
submit data
604.559 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2ZHL 1.75 Å NON-ENZYME: BINDING CRYSTAL STRUCTURE OF HUMAN GALECTIN-9 N-TERMINAL CRD IN COMP N-ACETYLLACTOSAMINE DIMER (CRYSTAL 2) HOMO SAPIENS BETA SANDWICH CARBOHYDRATE BINDING PROTEIN GALECTIN SUGARPROTEIN
Ref.: STRUCTURAL ANALYSIS OF THE RECOGNITION MECHANISM OF POLY-N-ACETYLLACTOSAMINE BY THE HUMAN GALECTIN-9 N-CARBOHYDRATE RECOGNITION DOMAIN. GLYCOBIOLOGY V. 19 112 2009
Members (7)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 473 families.
1 2EAL - GAL NGA A2G n/a n/a
2 2ZHL Kd = 3 uM NAG GAL GAL NAG n/a n/a
3 2ZHK Kd = 3 uM NAG GAL GAL NAG n/a n/a
4 2ZHN - NAG GAL NAG GAL GAL NAG n/a n/a
5 2ZHM - NAG GAL GAL NAG GAL n/a n/a
6 2EAK - LBT C12 H22 O11 C([C@@H]1[....
7 3WLU - LSE C18 H36 O10 Se Si C[Si](C)(C....
70% Homology Family (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 355 families.
1 2D6N - GAL NAG n/a n/a
2 2D6M - LBT C12 H22 O11 C([C@@H]1[....
3 2D6O - NAG GAL GAL NAG n/a n/a
4 2EAL - GAL NGA A2G n/a n/a
5 2ZHL Kd = 3 uM NAG GAL GAL NAG n/a n/a
6 2ZHK Kd = 3 uM NAG GAL GAL NAG n/a n/a
7 2ZHN - NAG GAL NAG GAL GAL NAG n/a n/a
8 2ZHM - NAG GAL GAL NAG GAL n/a n/a
9 2EAK - LBT C12 H22 O11 C([C@@H]1[....
10 3WLU - LSE C18 H36 O10 Se Si C[Si](C)(C....
50% Homology Family (94)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 272 families.
1 5NF9 Kd = 4.7 uM 8VW C22 H32 N2 O12 CC(=O)N[C@....
2 5E8A Kd = 0.034 uM 5KS C28 H30 F2 N6 O8 S c1cc(ccc1c....
3 1A3K - GAL NAG n/a n/a
4 3T1M Kd = 0.91 mM DQT C23 H27 N O7 Cc1ccc(cc1....
5 4LBL Kd = 11 uM BGC SIA GAL n/a n/a
6 2NMN Kd = 260 uM GAL BGC n/a n/a
7 4R9B - LAT C12 H22 O11 C([C@@H]1[....
8 2NN8 Kd = 260 uM LAT C12 H22 O11 C([C@@H]1[....
9 4JC1 Kd = 50 uM TDG C12 H22 O10 S C([C@@H]1[....
10 4R9A - LAT C12 H22 O11 C([C@@H]1[....
11 5EXO - 5SY C19 H22 O9 CC(=O)O[C@....
12 5E88 Kd = 0.065 uM 5KT C24 H28 N6 O8 S3 c1cscc1c2c....
13 4R9D - LAT C12 H22 O11 C([C@@H]1[....
14 1KJL Kd = 67 uM GAL NAG n/a n/a
15 3T1L Kd = 0.55 mM MQT C17 H22 O8 Cc1ccc(cc1....
16 2XG3 Kd = 18.2 uM UNU GAL NAG n/a n/a
17 4LBJ Kd = 0.39 uM GAL NAG GAL BGC n/a n/a
18 4R9C - LAT C12 H22 O11 C([C@@H]1[....
19 3ZSJ Kd = 231 uM LAT C12 H22 O11 C([C@@H]1[....
20 4LBM Kd = 0.97 uM BGC GAL NAG GAL n/a n/a
21 1KJR Kd = 0.88 uM BEK GAL NAG n/a n/a
22 3AYE - LAT C12 H22 O11 C([C@@H]1[....
23 5E89 Kd = 0.014 uM TD2 C28 H30 F2 N6 O8 S c1cc(cc(c1....
24 4LBO Kd = 1.7 uM BGC GAL SIA n/a n/a
25 2NMO Kd = 260 uM GAL BGC n/a n/a
26 3AYC Kd = 57 uM GAL NGA GAL BGC SIA n/a n/a
27 4JCK Kd = 4.3 mM 1LL C12 H22 O10 S C([C@@H]1[....
28 5NFA Kd = 5.6 uM 8VQ C24 H36 N2 O12 CC(=O)N[C@....
29 4LBK Kd = 0.32 uM GAL NAG GAL BGC n/a n/a
30 4RL7 - LAT C12 H22 O11 C([C@@H]1[....
31 3AYD Kd = 65 uM NPO A2G GAL n/a n/a
32 4LBN Kd = 0.65 uM GLC GAL NAG GAL n/a n/a
33 2D6N - GAL NAG n/a n/a
34 2D6M - LBT C12 H22 O11 C([C@@H]1[....
35 2D6O - NAG GAL GAL NAG n/a n/a
36 4XBN Kd = 93 uM GAL NAG n/a n/a
37 5H9R Kd = 0.84 uM TGZ C20 H26 F N3 O9 S c1cc(cc(c1....
38 5H9P Kd = 0.068 uM TD2 C28 H30 F2 N6 O8 S c1cc(cc(c1....
39 5DG2 - GAL GLC n/a n/a
40 5EWS - GAL BGC n/a n/a
41 4XBL Kd = 340 uM GAL NAG n/a n/a
42 4Y24 Kd = 0.22 uM TD2 C28 H30 F2 N6 O8 S c1cc(cc(c1....
43 3T2T - MQT C17 H22 O8 Cc1ccc(cc1....
44 3OY8 Kd = 220 uM GAL GCO n/a n/a
45 2EAL - GAL NGA A2G n/a n/a
46 2ZHL Kd = 3 uM NAG GAL GAL NAG n/a n/a
47 2ZHK Kd = 3 uM NAG GAL GAL NAG n/a n/a
48 2ZHN - NAG GAL NAG GAL GAL NAG n/a n/a
49 2ZHM - NAG GAL GAL NAG GAL n/a n/a
50 2EAK - LBT C12 H22 O11 C([C@@H]1[....
51 3WLU - LSE C18 H36 O10 Se Si C[Si](C)(C....
52 5H9S Kd = 87 uM TGZ C20 H26 F N3 O9 S c1cc(cc(c1....
53 5H9Q Kd = 38 uM TD2 C28 H30 F2 N6 O8 S c1cc(cc(c1....
54 4XBQ Kd = 270 uM GAL NAG n/a n/a
55 5T7S Kd = 3.1 uM LBT C12 H22 O11 C([C@@H]1[....
56 4BMB Ka = 13000 M^-1 LAT C12 H22 O11 C([C@@H]1[....
57 5T7I Kd = 0.33 uM LAT NAG GAL n/a n/a
58 3VKO - SIA GAL NAG n/a n/a
59 4BME Ka = 13000 M^-1 LBT C12 H22 O11 C([C@@H]1[....
60 5T7T Kd = 2.1 uM GAL NAG n/a n/a
61 3I8T Kd = 600 uM LBT C12 H22 O11 C([C@@H]1[....
62 3WV6 - GAL BGC n/a n/a
63 3NV2 - GAL NDG n/a n/a
64 3NV4 - SIA GAL BGC n/a n/a
65 3NV3 - GAL NAG MAN n/a n/a
66 3WUD Kd = 41 uM GLC GAL n/a n/a
67 3GAL - 1GN C6 H13 N O5 C([C@@H]1[....
68 4UW6 - VV7 C69 H73 N20 O39 [H]1c2c(cc....
69 2GAL - GAL C6 H12 O6 C([C@@H]1[....
70 4GAL - GAL BGC n/a n/a
71 4UW3 - 50G C31 H50 N10 O18 c1c(nnn1[C....
72 4UW4 - 4S0 C49 H80 N10 O33 c1c(nnn1[C....
73 3ZXE Kd = 450 uM PGZ C22 H28 N O8 P S Cc1ccc(cc1....
74 5GAL - NAG GAL n/a n/a
75 4UW5 - 4S0 C49 H80 N10 O33 c1c(nnn1[C....
76 1GAN - NDG GAL n/a n/a
77 1A78 - TDG C12 H22 O10 S C([C@@H]1[....
78 5DUW Kd = 510 uM 5GO C12 H22 O14 S C([C@@H]1[....
79 5DUV Kd = 1300 uM LAT C12 H22 O11 C([C@@H]1[....
80 5DUX Kd = 380 uM LAT FUC n/a n/a
81 4WVV - LBT C12 H22 O11 C([C@@H]1[....
82 4WVW - SLT C23 H39 N O19 CC(=O)N[C@....
83 4YLZ Kd = 270 uM LAT NAG GAL n/a n/a
84 5CBL - LAT C12 H22 O11 C([C@@H]1[....
85 4YM2 Kd = 1400 uM SGA BGC n/a n/a
86 4YM3 Kd = 1900 uM LAT C12 H22 O11 C([C@@H]1[....
87 4YM1 Kd = 580 uM LAT FUC n/a n/a
88 1IS4 - LAT C12 H22 O11 C([C@@H]1[....
89 1WLD - GAL BGC n/a n/a
90 5NFB Kd = 0.77 uM 8VT C30 H40 N2 O13 CC(=O)N[C@....
91 5NF7 Kd = 37.5 uM 8VZ C16 H28 N2 O11 CC(=O)N[C@....
92 1SLB - NAG MAN GAL MAN MAN NAG GAL n/a n/a
93 1SLT - NDG GAL n/a n/a
94 1SLA - NAG MAN GAL BMA NAG MAN NAG GAL n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GAL NGA A2G; Similar ligands found: 265
No: Ligand ECFP6 Tc MDL keys Tc
1 GAL NGA A2G 1 1
2 A2G GAL 0.877193 0.918367
3 GAL NGA 0.877193 0.918367
4 GAL A2G 0.877193 0.918367
5 NAG NGA 0.692308 0.979592
6 NAG A2G 0.692308 0.979592
7 FUC NAG 0.651515 0.918367
8 GAL NDG 0.621212 0.918367
9 NDG GAL 0.621212 0.918367
10 NLC 0.621212 0.918367
11 NAG BDP 0.614286 0.882353
12 BM3 0.614035 0.816327
13 NAG 0.614035 0.816327
14 HSQ 0.614035 0.816327
15 NDG 0.614035 0.816327
16 NGA 0.614035 0.816327
17 A2G 0.614035 0.816327
18 DR3 0.6 0.938776
19 NAG GAL FUC 0.6 0.938776
20 GAL MGC 0.597015 0.92
21 1GN ACY GAL ACY 1GN BGC GAL BGC 0.576471 0.979592
22 ACY 1GN GAL 1GN BGC ACY GAL BGC 0.576471 0.979592
23 NAG BDP NAG BDP NAG BDP NAG 0.571429 0.941176
24 NAG GCU NAG GCU NAG GCU 5AX 0.571429 0.941176
25 MAN BMA NAG 0.567568 0.918367
26 GLA GAL NAG 0.567568 0.918367
27 NAG GAL GAL 0.567568 0.918367
28 GC4 NAG 0.56 0.882353
29 FUC NDG GAL 0.552632 0.938776
30 GAL NAG FUC 0.552632 0.938776
31 FUC NAG GAL 0.552632 0.938776
32 GAL NDG FUC 0.552632 0.938776
33 UCD 0.532468 0.865385
34 GAD NDG 0.525641 0.849057
35 GCD NGA 0.525641 0.849057
36 NAG GAD 0.525641 0.849057
37 NGA GCD 0.525641 0.849057
38 LAT NAG GAL 0.518519 0.918367
39 GAL NAG GAL BGC 0.518519 0.918367
40 BGC GAL NAG GAL 0.518519 0.918367
41 A2G SER GAL 0.512821 0.921569
42 NGA SER GAL 0.512821 0.921569
43 GAL TNR 0.512821 0.921569
44 GAL SER A2G 0.512821 0.921569
45 GAL NAG GAL NAG GAL NAG 0.512195 0.96
46 NAG GAL GAL NAG 0.512195 0.979592
47 8VZ 0.507042 0.96
48 NAG GDL 0.506849 0.979592
49 CBS 0.506849 0.979592
50 NAG NDG 0.506849 0.979592
51 CBS CBS 0.506849 0.979592
52 GAL BGC NAG GAL 0.506173 0.918367
53 GAL NGA GLA BGC GAL 0.494118 0.918367
54 NAG GAL NAG 0.493827 0.979592
55 GAL A2G THR 0.493827 0.941176
56 MAN NAG GAL 0.493671 0.918367
57 GAL NAG MAN 0.493671 0.918367
58 GAL NAG 0.493151 0.918367
59 NGA GAL 0.493151 0.918367
60 NAG GAL 0.493151 0.918367
61 NPO A2G GAL 0.488095 0.723077
62 GAL A2G NPO 0.488095 0.723077
63 GAL A2G MBN 0.487805 0.865385
64 NAG BMA 0.486486 0.830189
65 AMU 0.485714 0.877551
66 NAG NAG NAG NAG NAG NAG NAG NAG 0.480519 0.96
67 NAG NAG NAG NAG NDG NAG 0.480519 0.96
68 NDG NAG NAG NDG 0.480519 0.96
69 CTO 0.480519 0.96
70 NAG NAG NAG NAG 0.480519 0.96
71 NDG NAG NAG 0.480519 0.96
72 NAG NAG NAG NDG 0.480519 0.96
73 NAG NAG NDG 0.480519 0.96
74 NAG NAG NAG NAG NDG 0.480519 0.96
75 NAG NAG NAG 0.480519 0.96
76 NAG NAG NAG NAG NAG NAG 0.480519 0.96
77 NAG NAG NAG NAG NAG 0.480519 0.96
78 NDG NAG NAG NAG 0.480519 0.96
79 NDG NAG NAG NDG NAG 0.480519 0.96
80 MAN NAG 0.479452 0.918367
81 MAN MAN 0.476923 0.673469
82 2M4 0.476923 0.673469
83 BGC BGC 0.476923 0.673469
84 NAG GAL GAL NAG GAL 0.47619 0.979592
85 NAG BMA MAN MAN MAN MAN 0.47191 0.918367
86 CG3 A2G GAL 0.471264 0.712121
87 LB2 0.469697 0.673469
88 MAN GLC 0.469697 0.673469
89 M3M 0.469697 0.673469
90 G6S NAG 0.469136 0.714286
91 LOG GAL 0.467532 0.779661
92 GAL LOG 0.467532 0.779661
93 FUC GL0 A2G 0.463415 0.938776
94 A2G GLA FUC 0.463415 0.938776
95 NGA GAL FUC 0.463415 0.938776
96 FUC GLA A2G 0.463415 0.938776
97 A2G GAL FUC 0.463415 0.938776
98 FUC GAL A2G 0.463415 0.938776
99 NGA GAL BGC 0.4625 0.918367
100 GAL NAG GAL FUC 0.45977 0.938776
101 GLA NAG GAL FUC 0.45977 0.938776
102 NGA GAL SIA 0.459184 0.90566
103 SIA GAL A2G 0.459184 0.90566
104 NAG BDP NAG BDP 0.458333 0.888889
105 NAG GAL BGC 0.457831 0.918367
106 MAG FUC GAL 0.45679 0.901961
107 NDG NAG 0.454545 0.96
108 GAL NOK 0.454545 0.789474
109 NOK GAL 0.454545 0.789474
110 GLC GAL NAG GAL 0.453488 0.918367
111 FUC GLA GLA 0.453333 0.693878
112 GAL GAL FUC 0.453333 0.693878
113 FUC GAL GLA 0.453333 0.693878
114 NAG FUC 0.453333 0.897959
115 GLA GAL FUC 0.453333 0.693878
116 GLA GLA FUC 0.453333 0.693878
117 GAL NAG FUC FUC 0.452381 0.92
118 FUC GAL NDG FUC 0.452381 0.92
119 FUC NDG GAL FUC 0.452381 0.92
120 GAL NDG FUC FUC 0.452381 0.92
121 GAL NAG GAL 0.452381 0.882353
122 BDZ 0.452381 0.92
123 BCW 0.452381 0.92
124 FUC GAL NAG FUC 0.452381 0.92
125 FUC NAG GAL FUC 0.452381 0.92
126 FUC GAL NAG 0.451219 0.938776
127 NDG GAL FUC 0.451219 0.938776
128 FUL GAL NAG 0.451219 0.938776
129 FUC GAL NDG 0.451219 0.938776
130 DR2 0.451219 0.938776
131 BMX 0.449275 0.711864
132 4QY 0.449275 0.711864
133 YX1 0.449275 0.636364
134 16G 0.449275 0.711864
135 NGA GLA GAL BGC 0.448276 0.918367
136 MAG 0.447761 0.86
137 2F8 0.447761 0.86
138 NAG MUB 0.447059 0.941176
139 NAG AMU 0.447059 0.941176
140 STZ 0.442857 0.661538
141 BMA BMA MAN 0.442857 0.693878
142 NAG NAG BMA MAN MAN 0.442105 0.979592
143 MAN MAN NAG MAN NAG 0.442105 0.979592
144 NAG BDP NAG BDP NAG BDP 0.44 0.90566
145 BGC BGC BGC GLC BGC BGC 0.43662 0.673469
146 BGC BGC BGC 0.43662 0.673469
147 GLC BGC BGC BGC 0.43662 0.673469
148 BGC BGC BGC BGC BGC 0.43662 0.673469
149 BGC BGC BGC ASO BGC BGC ASO 0.43662 0.673469
150 GLC BGC BGC BGC BGC BGC BGC 0.43662 0.673469
151 NAG GAL FUC FUC A2G 0.43617 0.96
152 FUC GAL NAG A2G FUC 0.43617 0.96
153 BGN 0.434783 0.740741
154 NAG NDG BMA 0.430233 0.90566
155 NAG NAG BMA 0.430233 0.90566
156 A2G GAL NAG FUC 0.430108 0.96
157 RAM GLC GAL NAG NAG GLC 0.429825 0.942308
158 BMA NAG MAN MAN MAN MAN MAN MAN MAN 0.428571 0.918367
159 NAG MBG 0.428571 0.92
160 LAT 0.426471 0.673469
161 CBK 0.426471 0.673469
162 LBT 0.426471 0.673469
163 GLA GLA 0.426471 0.673469
164 MAL 0.426471 0.673469
165 CBI 0.426471 0.673469
166 GLC BGC 0.426471 0.673469
167 BGC BMA 0.426471 0.673469
168 BGC GLC 0.426471 0.673469
169 GAL BGC 0.426471 0.673469
170 MAB 0.426471 0.673469
171 N9S 0.426471 0.673469
172 GAL GLC 0.426471 0.673469
173 BGC GAL 0.426471 0.673469
174 GLC GAL 0.426471 0.673469
175 B2G 0.426471 0.673469
176 GLA GAL 0.426471 0.673469
177 BMA BMA 0.426471 0.673469
178 BMA GAL 0.426471 0.673469
179 SIZ 0.426471 0.75
180 MAL MAL 0.426471 0.693878
181 MBG A2G 0.423077 0.92
182 A2G MBG 0.423077 0.92
183 NAG MAN BMA NDG MAN NAG GAL 0.423077 0.96
184 GAL FUC 0.422535 0.673469
185 U63 0.422535 0.622642
186 GN1 0.422535 0.728814
187 NG1 0.422535 0.728814
188 M5G 0.419048 0.979592
189 CGC 0.418919 0.673469
190 BGC BGC GLC 0.418919 0.673469
191 TRE 0.416667 0.673469
192 NAG MAN GAL BMA NDG MAN NAG GAL 0.415842 0.96
193 MAN BMA NAG NAG MAN NAG GAL GAL 0.415842 0.96
194 NAG MAN MAN MAN NAG GAL NAG GAL 0.415842 0.96
195 NAG MAN GAL BMA NAG MAN NAG GAL 0.415842 0.96
196 UNU GAL NAG 0.41573 0.921569
197 M13 0.414286 0.68
198 GAL MBG 0.414286 0.68
199 MDM 0.414286 0.68
200 BMA MAN MAN 0.413333 0.673469
201 GLA MBG 0.411765 0.68
202 MAN MAN BMA 0.410959 0.673469
203 FUC BGC GAL 0.410256 0.693878
204 GLA GAL NAG FUC GAL GLC 0.41 0.938776
205 3QL 0.409639 0.90566
206 FUC BGC GAL NAG 0.408602 0.938776
207 EAG RAM RAM GLC RAM NAG RAM RAM GLC RAM 0.408163 0.941176
208 NAG NAG 0.407407 0.886792
209 SNG 0.405797 0.788462
210 4UZ 0.405063 0.773585
211 SN5 SN5 0.405063 0.811321
212 NAG NAG BMA MAN 0.404255 0.90566
213 GLC BGC BGC BGC BGC BGC 0.402778 0.673469
214 MAN BMA BMA BMA BMA 0.402778 0.673469
215 MLR 0.402778 0.673469
216 GLC GLC GLC GLC GLC 0.402778 0.673469
217 GLC GLC BGC GLC GLC GLC GLC 0.402778 0.673469
218 BMA BMA BMA 0.402778 0.673469
219 DXI 0.402778 0.673469
220 CEX 0.402778 0.673469
221 BGC GLC GLC GLC GLC 0.402778 0.673469
222 BMA BMA BMA BMA BMA 0.402778 0.673469
223 B4G 0.402778 0.673469
224 BGC GLC GLC 0.402778 0.673469
225 MAN MAN BMA BMA BMA BMA 0.402778 0.673469
226 GLC GLC BGC 0.402778 0.673469
227 CTT 0.402778 0.673469
228 GLC GAL GAL 0.402778 0.673469
229 CTR 0.402778 0.673469
230 GLC GLC GLC GLC GLC GLC GLC 0.402778 0.673469
231 GLC BGC GLC 0.402778 0.673469
232 BGC BGC BGC GLC 0.402778 0.673469
233 CEY 0.402778 0.673469
234 GLC BGC BGC 0.402778 0.673469
235 BGC BGC BGC BGC BGC BGC BGC BGC BGC 0.402778 0.673469
236 MT7 0.402778 0.673469
237 GAL GAL GAL 0.402778 0.673469
238 NGS 0.402778 0.646154
239 CE5 0.402778 0.673469
240 GLC GLC GLC GLC GLC GLC GLC GLC GLC 0.402778 0.673469
241 BGC GLC GLC GLC GLC GLC GLC 0.402778 0.673469
242 BGC BGC BGC BGC BGC BGC 0.402778 0.673469
243 CE6 0.402778 0.673469
244 MTT 0.402778 0.673469
245 BGC GLC GLC GLC 0.402778 0.673469
246 GLC GLC GLC GLC GLC GLC GLC GLC 0.402778 0.673469
247 CE8 0.402778 0.673469
248 CT3 0.402778 0.673469
249 BMA MAN BMA 0.402778 0.673469
250 BMA BMA BMA BMA BMA BMA 0.402778 0.673469
251 MAN BMA BMA 0.402778 0.673469
252 GLA GAL GLC 0.402778 0.673469
253 GLC BGC BGC BGC BGC 0.402778 0.673469
254 NAG MAN MAN 0.402299 0.918367
255 TCG 0.402299 0.813559
256 NAG MAN BMA 0.402299 0.918367
257 CTO TMX 0.402299 0.813559
258 GAL GC2 0.402299 0.671642
259 NAG NAG NAG NAG NAG NAG NAG 0.402174 0.907407
260 FUC GAL NAG GAL BGC 0.402062 0.938776
261 SIA 2FG NAG 0.4 0.842105
262 MAN BMA BMA BMA BMA BMA 0.4 0.693878
263 BMA BMA BMA BMA BMA BMA MAN 0.4 0.693878
264 BG8 0.4 0.784314
265 A2G GAL BGC FUC 0.4 0.938776
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2ZHL; Ligand: NAG GAL GAL NAG; Similar sites found: 186
This union binding pocket(no: 1) in the query (biounit: 2zhl.bio4) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3N0Y APC 0.0001091 0.5089 None
2 5IXG OTP 0.00128 0.48363 None
3 4ZSI 4R1 0.0007477 0.45623 None
4 4ZSI GLP 0.0007852 0.45524 None
5 3EKK GS2 0.004112 0.4483 None
6 1QY1 PRZ 0.003207 0.43488 None
7 2Y88 2ER 0.008086 0.43354 None
8 5JFS 6K0 0.01245 0.42721 None
9 5N2F 8HW 0.00564 0.42493 None
10 4IPH 1FJ 0.0157 0.40664 None
11 3K3K A8S 0.01323 0.40381 None
12 3FW4 CAQ 0.02002 0.40149 None
13 2P7Q GG6 0.005386 0.40131 None
14 5J8O 6GZ 0.01206 0.40005 None
15 3ZO7 K6H 0.005251 0.40003 None
16 3RGA LSB 0.0004491 0.46651 1.35135
17 3E85 BSU 0.003358 0.45607 1.35135
18 5EPQ OLA 0.006851 0.4115 1.35135
19 2A1L PCW 0.001593 0.47675 2.02703
20 2Y6O 1N1 0.002312 0.44164 2.02703
21 3QRC SCR 0.000000943 0.43639 2.02703
22 5KO1 6UY 0.003117 0.42742 2.02703
23 2YG2 FLC 0.009022 0.4198 2.02703
24 1NYW DAU 0.005891 0.41861 2.02703
25 1IIU RTL 0.008734 0.41414 2.02703
26 4RYV ZEA 0.003686 0.41227 2.02703
27 2YG2 S1P 0.01209 0.40904 2.02703
28 5IXH OTP 0.03015 0.4085 2.02703
29 5MJA 7O3 0.007206 0.40832 2.02703
30 3W68 VIV 0.01678 0.40219 2.02703
31 4YGF AZM 0.01604 0.40152 2.02703
32 4TW7 37K 0.0149 0.40917 2.34375
33 3L5R 47X 0.03356 0.42977 2.45902
34 4WN5 MVC 0.0131 0.40736 2.6087
35 5BYZ 4WE 0.005049 0.4377 2.7027
36 3PP0 03Q 0.005917 0.42393 2.7027
37 3PQB VGP 0.009242 0.41297 2.7027
38 1TT8 PHB 0.014 0.41049 2.7027
39 5A89 ADP 0.04559 0.40009 2.7027
40 4K55 H6P 0.0001269 0.41234 3.22581
41 5DQ8 FLF 0.005189 0.42833 3.33333
42 5DRB 5FJ 0.0003175 0.51367 3.37838
43 5EOB 5QQ 0.0004723 0.51174 3.37838
44 4MNS 2AX 0.0006876 0.49949 3.37838
45 1DY4 SNP 0.007714 0.45358 3.37838
46 4FHD 0TT 0.004764 0.44026 3.37838
47 4FHD EEM 0.004764 0.44026 3.37838
48 4NV7 COA 0.006955 0.42675 3.37838
49 2VFT SOR 0.002234 0.42291 3.37838
50 2XVD AS6 0.009443 0.42165 3.37838
51 4RFR RHN 0.005797 0.41894 3.37838
52 4U03 TLL 0.03972 0.41304 3.37838
53 4U03 GTP 0.03972 0.41304 3.37838
54 5KEW 6SB 0.002459 0.4121 3.47222
55 1KGI T4A 0.01358 0.40819 3.93701
56 5HA0 LTD 0.002929 0.44353 4.05405
57 3LVW GSH 0.00783 0.43425 4.05405
58 1SMR PIV HIS PRO PHE HIS LPL TYR TYR SER 0.01141 0.42602 4.05405
59 4H2V AMP 0.006234 0.42113 4.05405
60 5EYK 5U5 0.009322 0.42054 4.05405
61 4ZU4 4TG 0.006187 0.41761 4.05405
62 3MF2 AMP 0.009611 0.41383 4.05405
63 4C2V YJA 0.01598 0.41171 4.05405
64 3FW9 SLX 0.009963 0.40785 4.05405
65 4H2X G5A 0.01021 0.40734 4.05405
66 4H2W 5GP 0.01014 0.40557 4.05405
67 4H2W AMP 0.009315 0.40528 4.05405
68 5JSD ACY 1GN GAL 1GN BGC ACY GAL BGC 0.04007 0.40122 4.05405
69 1ZB6 GST 0.000545 0.48384 4.72973
70 1ZB6 DIN 0.000506 0.48384 4.72973
71 5J75 6GQ 0.0005481 0.45998 4.72973
72 1ERB ETR 0.01188 0.41539 4.72973
73 4BQY FNT 0.009359 0.41096 4.72973
74 5MY8 RXZ 0.02104 0.40044 4.72973
75 3W9R A8S 0.009743 0.40001 4.72973
76 3VQ2 LP4 LP5 MYR DAO 0.00557 0.44795 4.86111
77 5C3R AKG 0.01041 0.40504 4.95627
78 5C3R HMU 0.01041 0.40504 4.95627
79 1N5S ADL 0.0002379 0.47932 5.35714
80 3WDX BGC BGC GLC 0.0003627 0.47778 5.40541
81 2AG4 OLA 0.004662 0.46224 5.40541
82 2AG4 LP3 0.005135 0.46224 5.40541
83 5VC5 96M 0.002869 0.44551 5.40541
84 1GP6 QUE 0.004241 0.43573 5.40541
85 4QA8 PJZ 0.006222 0.42454 5.40541
86 4PFC 2QX 0.0084 0.42131 5.40541
87 4KBA 1QM 0.01238 0.41452 5.40541
88 2CM4 RCL 0.009923 0.4115 5.40541
89 3ILR SGN 0.03945 0.40746 5.40541
90 3ILR IXD 0.03945 0.40746 5.40541
91 3ILR SGN IXD 0.04352 0.40746 5.40541
92 4CYI ATP 0.0116 0.40473 5.40541
93 2OVW CBI 0.004196 0.40423 5.40541
94 4CQE CQE 0.03472 0.40253 5.40541
95 5FU3 BGC BGC BGC 0.0006739 0.42087 5.66038
96 3GC8 B45 0.003487 0.43315 6.08108
97 3E2M E2M 0.006674 0.42465 6.08108
98 3B00 16A 0.005917 0.40499 6.08108
99 2E3N 6CM 0.02632 0.40446 6.08108
100 1UNB AKG 0.005795 0.47661 6.75676
101 1UNB PN1 0.006481 0.47661 6.75676
102 4U0W 16G 0.0008811 0.45524 6.75676
103 4DE9 VTP 0.004681 0.43933 6.75676
104 1GT4 UNA 0.002081 0.43558 6.75676
105 5ML3 DL3 0.01459 0.42168 6.75676
106 4LOO SB4 0.006266 0.41538 6.75676
107 4RFM 3P6 0.02949 0.41409 6.75676
108 1MJJ HAL 0.02067 0.40082 6.75676
109 1OGX EQU 0.003251 0.42429 6.87023
110 2HKA C3S 0.01285 0.40441 6.92308
111 3E8N ATP 0.001999 0.4717 7.43243
112 3E8N VRA 0.001999 0.4717 7.43243
113 2GJ5 VD3 0.01067 0.42855 7.43243
114 2XMY CDK 0.02631 0.42645 7.43243
115 4QJP V1F 0.006666 0.42467 7.43243
116 5MZI FYK 0.04252 0.4146 7.43243
117 5MZI FAD 0.04143 0.4146 7.43243
118 4CSV STI 0.01584 0.4034 7.43243
119 3IAL PR8 0.01633 0.40276 7.43243
120 3PG7 PTY 0.0276 0.40113 7.43243
121 5FPX GLY SER SER HIS HIS HIS HIS HIS 0.002116 0.43955 7.9646
122 3AGC RCC 0.002427 0.44904 8.10811
123 1DZK PRZ 0.005848 0.4147 8.10811
124 1UU6 BGC BGC BGC BGC 0.01898 0.40405 8.10811
125 4ZZW CBI 0.03133 0.40381 8.10811
126 1M15 ARG 0.03257 0.40089 8.10811
127 1M15 ADP 0.03257 0.40089 8.10811
128 4F7E 0SH 0.004464 0.44981 8.16327
129 3L9R L9Q 0.006467 0.43612 8.16327
130 3L9R L9R 0.01104 0.42451 8.16327
131 1EWF PC1 0.03208 0.40711 8.78378
132 4WVO 3UZ 0.004053 0.4382 9.45946
133 3SXS PP2 0.004952 0.42407 9.45946
134 1U0A BGC BGC BGC BGC 0.005912 0.41448 9.45946
135 4LA7 A1O 0.01168 0.41286 9.45946
136 1MH5 HAL 0.01289 0.41079 9.45946
137 5A3T MMK 0.02066 0.40741 9.45946
138 1UMZ BGC BGC XYS BGC XYS GAL 0.003604 0.40531 9.45946
139 2E56 MYR 0.02197 0.40607 9.72222
140 1LEK GLU GLN TYR LYS PHE TYR SER VAL 0.0479 0.41354 10.101
141 1MHC FME TYR PHE ILE ASN ILE LEU THR LEU 0.01803 0.41154 10.101
142 3Q8G PEE 0.006788 0.45214 10.1351
143 1VA6 P2S 0.02247 0.41114 10.1351
144 1VA6 ADP 0.021 0.4105 10.1351
145 1OJJ GLC GAL 0.003744 0.41044 10.1351
146 4AG8 AXI 0.02442 0.40827 10.1351
147 1OJK GLC BGC 0.004444 0.4072 10.1351
148 3TAY MN0 0.01624 0.40593 10.1351
149 4KYS VIB 0.004203 0.40007 10.1351
150 1D5Z ACE ALC ARG ALA ODA SER LEU NH2 0.002129 0.46143 10.8108
151 3M3R BCD 0.006197 0.44259 10.8108
152 5BVE 4VG 0.0247 0.42603 10.8108
153 1ZM1 BGC BGC BGC 0.00512 0.41739 11.4865
154 1ODM ASV 0.0004714 0.48022 12.1622
155 5EW9 5VC 0.03036 0.43786 12.1622
156 1QIN GIP 0.008661 0.42738 12.1622
157 5H2U 1N1 0.007817 0.41088 12.1622
158 4JH6 FCN 0.00496 0.40176 12.3188
159 4GJ3 0XP 0.0065 0.43229 12.8378
160 3MTX PGT 0.01071 0.4228 14.1892
161 5TA6 79D 0.02355 0.40081 14.1892
162 4QCK ASD 0.0205 0.42832 14.8649
163 5FXD H7Y 0.008193 0.40788 14.8649
164 4CVZ TYR GLU LEU ASP GLU LYS PHE ASP ARG LEU 0.03145 0.40373 15.3061
165 2RG0 CTT 0.002938 0.44649 15.5405
166 2RFZ CTR 0.01042 0.40692 15.5405
167 2Z77 HE7 0.0007807 0.46787 15.8273
168 3QUZ QUV 0.002221 0.47584 16.1616
169 3RUG DB6 0.002201 0.47246 16.1616
170 5FKP 6UL 0.0009597 0.47025 16.1616
171 3SCM LGN 0.004603 0.46175 16.1616
172 3G08 FEE 0.0206 0.42681 16.1616
173 4WO4 JLS 0.003568 0.4558 18
174 5U98 1KX 0.002071 0.46779 18.1818
175 3HUJ AGH 0.02734 0.41737 18.1818
176 5FBN 5WF 0.006313 0.43544 18.2432
177 4HWT 1B2 0.007803 0.41286 18.2432
178 5L2J 70E 0.003579 0.47471 18.3673
179 5L2J 6UL 0.005806 0.46217 18.3673
180 5A65 TPP 0.006827 0.41746 19.5946
181 5A5W GUO 0.04237 0.40087 20.2703
182 4XT2 43L 0.01119 0.41065 20.6612
183 3IS2 FAD 0.02124 0.40431 22.973
184 3M3E GAL A2G NPO 0.00000003205 0.51641 27.7027
185 1QKQ MAN 0.00000004824 0.43411 42.2535
186 3VV1 GAL FUC 0.0000000005198 0.57 45.9459
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