Receptor
PDB id Resolution Class Description Source Keywords
1GP6 1.75 Å EC: 1.14.11.19 ANTHOCYANIDIN SYNTHASE FROM ARABIDOPSIS THALIANA COMPLEXED WITH TRANS-DIHYDROQUERCETIN (WITH 30 MIN EXPOSURE TO O2) ARABIDOPSIS THALIANA OXIDOREDUCTASE OXYGENASE 2-OXOGLUTARATE DEPENDENT DIOXYGENFLAVONOID BIOSYNTHESIS
Ref.: STRUCTURE AND MECHANISM OF ANTHOCYANIDIN SYNTHASE F ARABIDOPSIS THALIANA. STRUCTURE V. 10 93 2002
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
DH2 A:385;
Valid;
none;
submit data
304.252 C15 H12 O7 c1cc(...
FE2 A:390;
Part of Protein;
none;
submit data
55.845 Fe [Fe+2...
MES A:375;
A:376;
Invalid;
Invalid;
none;
none;
submit data
195.237 C6 H13 N O4 S C1COC...
QUE A:380;
Valid;
none;
submit data
302.236 C15 H10 O7 c1cc(...
SIN A:370;
Valid;
none;
submit data
116.072 C4 H6 O4 O=C([...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1GP6 1.75 Å EC: 1.14.11.19 ANTHOCYANIDIN SYNTHASE FROM ARABIDOPSIS THALIANA COMPLEXED WITH TRANS-DIHYDROQUERCETIN (WITH 30 MIN EXPOSURE TO O2) ARABIDOPSIS THALIANA OXIDOREDUCTASE OXYGENASE 2-OXOGLUTARATE DEPENDENT DIOXYGENFLAVONOID BIOSYNTHESIS
Ref.: STRUCTURE AND MECHANISM OF ANTHOCYANIDIN SYNTHASE F ARABIDOPSIS THALIANA. STRUCTURE V. 10 93 2002
Members (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1GP4 - AKG C5 H6 O5 C(CC(=O)O)....
2 1GP6 - QUE C15 H10 O7 c1cc(c(cc1....
3 1GP5 - DH2 C15 H12 O7 c1cc(c(cc1....
4 2BRT - NAR C15 H12 O5 c1cc(ccc1[....
70% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1GP4 - AKG C5 H6 O5 C(CC(=O)O)....
2 1GP6 - QUE C15 H10 O7 c1cc(c(cc1....
3 1GP5 - DH2 C15 H12 O7 c1cc(c(cc1....
4 2BRT - NAR C15 H12 O5 c1cc(ccc1[....
50% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1GP4 - AKG C5 H6 O5 C(CC(=O)O)....
2 1GP6 - QUE C15 H10 O7 c1cc(c(cc1....
3 1GP5 - DH2 C15 H12 O7 c1cc(c(cc1....
4 2BRT - NAR C15 H12 O5 c1cc(ccc1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: DH2; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 DQH 1 1
2 DH2 1 1
3 KXN 0.434783 0.875
4 28E 0.434783 0.875
Ligand no: 2; Ligand: QUE; Similar ligands found: 12
No: Ligand ECFP6 Tc MDL keys Tc
1 QUE 1 1
2 KMP 0.678571 0.967742
3 MYC 0.649123 1
4 MYU 0.57377 1
5 MRI 0.557377 0.967742
6 FSE 0.52459 0.967742
7 6JM 0.516129 0.967742
8 CC6 0.515625 0.967742
9 QCT 0.481013 0.885714
10 LU2 0.454545 1
11 NRA 0.40625 0.903226
12 RUT 0.402062 0.738095
Ligand no: 3; Ligand: SIN; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 SIN 1 1
2 MLI 0.5 0.785714
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1GP6; Ligand: QUE; Similar sites found: 199
This union binding pocket(no: 1) in the query (biounit: 1gp6.bio1) has 27 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3WG3 A2G GAL NAG FUC 0.00264 0.45559 None
2 1OFL NGK GCD 0.01419 0.41995 1.40449
3 4YRD 3IT 0.002494 0.45136 1.68539
4 3PUA OGA 0.006003 0.4435 1.68539
5 2Z48 NGA 0.01395 0.43055 1.68539
6 2Z49 AMG 0.02542 0.40154 1.68539
7 1WNB BTL 0.004678 0.48002 1.96629
8 2OG7 SIN 0.003163 0.44604 1.96629
9 5IN3 G1P 0.02811 0.40597 1.96629
10 2Y0I AKG 0.03408 0.40157 1.98864
11 2WA4 069 0.001164 0.46297 2.00573
12 4B7E OGA 0.02046 0.41377 2.00573
13 2XUM OGA 0.0176 0.41127 2.00573
14 3P3N AKG 0.02766 0.40277 2.00573
15 3MF2 AMP 0.002558 0.4191 2.02312
16 2RDQ AKG 0.001632 0.43079 2.08333
17 4BXF AKG 0.0002268 0.52022 2.24719
18 4CCN OGA 0.003714 0.45106 2.24719
19 4CCK OGA 0.00533 0.44227 2.24719
20 4Y3O OGA 0.006054 0.44116 2.24719
21 4CCO OGA 0.01478 0.42184 2.24719
22 1ZHX HC3 0.004412 0.40042 2.24719
23 1ZX5 LFR 0.01751 0.44059 2.33333
24 3RGA LSB 0.002363 0.43918 2.4735
25 4HN1 TYD 0.003085 0.44714 2.48756
26 1I82 BGC BGC 0.02212 0.41456 2.6455
27 1RL4 BL5 0.02437 0.40383 2.65957
28 4OJ8 AKG 0.0009584 0.44453 2.73038
29 4OJ8 2TQ 0.005468 0.40529 2.73038
30 3AVR OGA 0.001676 0.47338 2.80899
31 3AVS OGA 0.003162 0.4516 2.80899
32 1OJJ GLC GAL 0.004473 0.44392 2.80899
33 2OVW CBI 0.01054 0.42492 2.80899
34 3FW9 SLX 0.01123 0.40107 2.80899
35 4AZI OAN 0.02603 0.40093 2.80899
36 1NX4 AKG 0.004573 0.45246 2.9304
37 3W8X FTK 0.01007 0.41748 2.99145
38 3ACL 3F1 0.004783 0.42498 3.04054
39 1EPB REA 0.003304 0.43243 3.04878
40 3KFF XBT 0.00298 0.45828 3.08642
41 3KFF ZBT 0.00298 0.45828 3.08642
42 4IE6 UN9 0.0002172 0.44053 3.08989
43 3X01 AMP 0.007701 0.4395 3.08989
44 5A3T MMK 0.001357 0.42677 3.08989
45 5IQT AKG 0.003626 0.41939 3.08989
46 2JIG PD2 0.00000156 0.61985 3.125
47 3SAO DBH 0.02402 0.41331 3.125
48 3SAO NKN 0.01996 0.40672 3.125
49 5L9V OGA 0.0001125 0.51852 3.1746
50 4BQY FNT 0.0000819 0.49097 3.1746
51 3QRC SCR 0.00001064 0.57752 3.18471
52 4IAW LIZ 0.004141 0.44078 3.19149
53 2FCU AKG 0.0003114 0.51206 3.19489
54 3H7J PPY 0.0007726 0.4665 3.29218
55 2IUW AKG 0.000001319 0.62355 3.36134
56 4IGQ OGA 0.0005149 0.4965 3.37079
57 4IGQ THR M3L GLN 0.0004925 0.46143 3.37079
58 1PIG GLC GLC 0.04116 0.40214 3.37079
59 4ZU4 4TG 0.001333 0.4507 3.37838
60 4GJY OGA 0.003121 0.45399 3.40426
61 3GL0 HXX 0.01667 0.4068 3.4384
62 4XCB HY0 0.0007678 0.43044 3.44828
63 4QM9 CYS 0.00189 0.46737 3.46821
64 2YG2 S1P 0.006537 0.40824 3.48837
65 2YG2 FLC 0.003725 0.40332 3.48837
66 2Z77 HE7 0.005599 0.41117 3.59712
67 2PNC CLU 0.006148 0.44414 3.65169
68 4M26 AKG 0.01547 0.42181 3.65169
69 4JZR 4JR 0.001238 0.47234 3.7037
70 5DG2 GAL GLC 0.0007342 0.46532 3.7037
71 2I74 MAN MAN MAN MAN 0.03412 0.40487 3.7037
72 2D6M LBT 0.00005915 0.57562 3.77358
73 5C5T AKG 0.000003598 0.60139 3.94737
74 1QY1 PRZ 0.0007767 0.41365 4.02299
75 3BP1 GUN 0.02604 0.41062 4.13793
76 4JGP PYR 0.02317 0.41358 4.14747
77 5V1B 8UY 0.002706 0.46047 4.16667
78 1TZD ADP 0.009122 0.43216 4.36364
79 3W21 AKG 0.002095 0.46352 4.3956
80 3O5N BR0 0.008719 0.42626 4.46429
81 3OYW TDG 0.000643 0.49308 4.47761
82 2ET1 GLV 0.001825 0.47193 4.47761
83 1W6P NDG GAL 0.002926 0.45685 4.47761
84 1W6O LAT 0.01567 0.4239 4.47761
85 1GZW GAL BGC 0.01854 0.4195 4.47761
86 1SLT NDG GAL 0.03846 0.40378 4.47761
87 2P7Q GG6 0.03325 0.40324 4.51128
88 2HZQ STR 0.04187 0.40006 4.5977
89 5ML3 DL3 0.004737 0.41213 4.69799
90 3KV5 OGA 0.008916 0.43884 4.77528
91 4QDF 30Q 0.01475 0.40223 4.77528
92 2A1X AKG 0.00001348 0.58184 4.87013
93 3W9F I3P 0.01878 0.43144 5
94 1Y2F WAI 0.01049 0.43096 5.03597
95 5E89 TD2 0.004384 0.42674 5.03597
96 5AVF TAU 0.02202 0.40851 5.05837
97 3BMN AX3 0.02045 0.41133 5.20833
98 1A78 TDG 0.002026 0.46817 5.22388
99 4J25 OGA 0.00005072 0.55225 5.24017
100 2DIO EOD 0.007069 0.42092 5.31915
101 2HKA C3S 0.006767 0.41088 5.38462
102 2ZHL NAG GAL GAL NAG 0.004241 0.43573 5.40541
103 4H2V AMP 0.001663 0.43044 5.45455
104 2VQ5 HBA 0.0275 0.40754 5.47264
105 4P7X YCP 0.0079 0.41129 5.47945
106 4P7X AKG 0.0079 0.41129 5.47945
107 1XNK XS2 0.01536 0.40853 5.61225
108 2XMY CDK 0.004227 0.43418 5.7047
109 2XOC ADP 0.02039 0.41245 5.74713
110 3K4Z CBI 0.0258 0.40744 5.88235
111 3B00 16A 0.02132 0.40528 5.88235
112 5FWE OGA 0.005887 0.44475 5.89888
113 2OS2 OGA 0.008078 0.43785 5.89888
114 2YBP 2HG 0.009482 0.43426 5.89888
115 5LY2 OGA 0.009432 0.43126 5.89888
116 3KV4 OGA 0.01942 0.41809 5.89888
117 5F3I 5UJ 0.007252 0.41809 5.89888
118 1NKI PPF 0.01241 0.42584 5.92593
119 2Q8E OGA 0.008155 0.43758 5.96591
120 2Q8C AKG 0.01035 0.43098 5.96591
121 4NAO AKG 0.001254 0.47176 6.13497
122 5FP3 3JI 0.001958 0.42396 6.17978
123 3VV1 GAL FUC 0.0004428 0.51317 6.25
124 1KGI T4A 0.004829 0.40454 6.29921
125 4L4J NAG NAG BMA MAN NAG 0.0001003 0.53605 6.33484
126 4NPL AKG 0.0000002482 0.6791 6.4
127 5AIG VPR 0.02478 0.402 6.4
128 5UQD AKG 0.008078 0.43893 6.46067
129 1UUY PPI 0.01069 0.42666 6.58683
130 4MOB ADP 0.009972 0.43245 6.62651
131 2ZWS PLM 0.0305 0.40107 6.74157
132 4OCT AKG 0.000002001 0.60536 6.75676
133 2CDO GAL AAL GAL AAL GAL AAL 0.007671 0.43312 6.875
134 2QX0 PH2 0.03271 0.40707 6.91824
135 4LIT AKG 0.001055 0.48238 7.02247
136 5FWJ MMK 0.001424 0.46925 7.02247
137 1I7E IBS 0.01644 0.42109 7.16981
138 1OIJ AKG 0.001243 0.46971 7.30897
139 1OIK AKG 0.002078 0.46456 7.30897
140 1OIK C26 0.002599 0.43727 7.30897
141 1J3R 6PG 0.003912 0.44201 7.36842
142 5FU3 BGC BGC BGC 0.005982 0.4448 7.54717
143 2YNE YNE 0.03383 0.40307 7.58427
144 2YNE NHW 0.03383 0.40307 7.58427
145 4WVW SLT 0.02364 0.40197 7.63889
146 2YMZ LAT 0.001247 0.44548 7.69231
147 4GGZ BTN 0.01418 0.41414 7.82609
148 2VFT SOR 0.007347 0.42839 7.86517
149 5FPX GLY SER SER HIS HIS HIS HIS HIS 0.0001633 0.4827 7.9646
150 1RZM E4P 0.02924 0.41117 7.98817
151 5TFZ 7BC 0.001776 0.46436 8
152 1C9K 5GP 0.01732 0.4098 8.33333
153 4RFR RHN 0.0000853 0.4382 8.37438
154 3M94 M7M 0.01687 0.41362 8.46561
155 5M0T AKG 0.01488 0.42244 8.5034
156 2GC0 PAN 0.005801 0.41738 8.51064
157 4M1U A2G MBG 0.003761 0.45256 8.57143
158 4H6B 10X 0.005487 0.4303 8.71795
159 4MJ0 SIA SIA 0.03809 0.40256 8.72727
160 4QXB OGA 0.0147 0.41753 8.82353
161 2GMH UQ5 0.0028 0.41746 8.98876
162 4XBT 3ZQ 0.01644 0.40709 9.03226
163 4XBT FLC 0.0176 0.40206 9.03226
164 3PUR 2HG 0.009523 0.43412 9.26966
165 1OS7 TAU 0.002299 0.428 9.54064
166 1OS7 AKG 0.002299 0.428 9.54064
167 1H2M OGA 0.02085 0.40704 9.61539
168 4H2X G5A 0.006063 0.41301 9.70874
169 1UPR 4IP 0.01412 0.43259 9.7561
170 1N5S ADL 0.004315 0.42706 9.82143
171 3MTX PGT 0.006436 0.40077 9.93377
172 2QL9 CIT 0.01957 0.4222 10.3093
173 2DDQ HRB 0.02627 0.40073 10.3286
174 1GT4 UNA 0.003576 0.43084 10.6918
175 4JH6 FCN 0.003384 0.4501 10.8696
176 2AGC DAO 0.02082 0.40977 11.1111
177 1CBK ROI 0.03987 0.40126 11.25
178 1ZZ7 S0H 0.01531 0.42103 11.6162
179 1NYW DAU 0.002254 0.43211 12.1827
180 1H2K OGA 0.01783 0.41076 12.1951
181 5T7I LAT NAG GAL 0.01246 0.42717 12.2581
182 5HV0 AKG 0.00003137 0.43411 12.4424
183 4W9N TCL 0.007263 0.43804 13.5693
184 3EW2 BTN 0.01061 0.42478 14.0741
185 3SCH TB6 0.002967 0.46318 14.6465
186 1ULE GLA GAL NAG 0.0002437 0.52637 14.6667
187 5KEW 6SB 0.004323 0.45324 15.9574
188 5LUN OGA 0.0000001175 0.68822 16.1932
189 5LUN ARG 0.000008349 0.50801 16.1932
190 2BOS GLA GAL 0.008367 0.42279 17.6471
191 4CS9 AMP 0.01668 0.42139 17.9894
192 1QFT HSM 0.005493 0.42219 26.8571
193 3HQR OGA 0.00001838 0.55026 29.4118
194 1UNB AKG 0.00001506 0.48322 34.4051
195 1UNB PN1 0.00001416 0.47078 34.4051
196 5L9B AKG 0.000086 0.52432 36.8421
197 1ODM ASV 0.00001508 0.50248 37.1601
198 5C3R AKG 0.0000000004418 0.73993 38.7755
199 5C3R HMU 0.0000000004418 0.73993 38.7755
Pocket No.: 2; Query (leader) PDB : 1GP6; Ligand: DH2; Similar sites found: 127
This union binding pocket(no: 2) in the query (biounit: 1gp6.bio1) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2A1L PCW 0.001474 0.44288 1.48148
2 2OVD DAO 0.03268 0.40433 1.64835
3 4YRD 3IT 0.002341 0.45136 1.68539
4 2Z49 AMG 0.02417 0.40154 1.68539
5 1WNB BTL 0.00443 0.48002 1.96629
6 5IN3 G1P 0.02655 0.40597 1.96629
7 3MF2 AMP 0.002798 0.41587 2.02312
8 4BXF AKG 0.0002095 0.52022 2.24719
9 4Y3O OGA 0.00568 0.44116 2.24719
10 1ZHX HC3 0.003826 0.40572 2.24719
11 1ZB6 GST 0.002333 0.41889 2.60586
12 1ZB6 DIN 0.003116 0.41233 2.60586
13 3AVR OGA 0.001562 0.47338 2.80899
14 1OJJ GLC GAL 0.004168 0.44392 2.80899
15 3FW9 SLX 0.01002 0.4018 2.80899
16 1EPB REA 0.004104 0.4265 3.04878
17 3KFF XBT 0.002962 0.45682 3.08642
18 3KFF ZBT 0.002962 0.45682 3.08642
19 3X01 AMP 0.00722 0.4395 3.08989
20 4IE6 UN9 0.0001855 0.43888 3.08989
21 5A3T MMK 0.001284 0.43095 3.08989
22 5IQT AKG 0.004191 0.41509 3.08989
23 2JIG PD2 0.000001404 0.61985 3.125
24 5L9V OGA 0.0001054 0.51803 3.1746
25 4BQY FNT 0.00007388 0.49097 3.1746
26 4IAW LIZ 0.005634 0.4326 3.19149
27 1M6P M6P 0.0252 0.40824 3.28947
28 3H7J PPY 0.0009421 0.46071 3.29218
29 2IUW AKG 0.006061 0.40193 3.36134
30 4IGQ THR M3L GLN 0.0004492 0.41759 3.37079
31 4ZU4 4TG 0.001298 0.44957 3.37838
32 4GJY OGA 0.00292 0.45399 3.40426
33 3GL0 HXX 0.01474 0.40797 3.4384
34 4XCB HY0 0.0006835 0.43584 3.44828
35 4QM9 CYS 0.001765 0.46737 3.46821
36 2YG2 FLC 0.003225 0.40871 3.48837
37 2Z77 HE7 0.001116 0.42206 3.59712
38 2PNC CLU 0.005768 0.44414 3.65169
39 4JZR 4JR 0.001147 0.47234 3.7037
40 5DG2 GAL GLC 0.0006892 0.46532 3.7037
41 2D6M LBT 0.001615 0.46493 3.77358
42 5BVE 4VG 0.02327 0.40171 3.93258
43 5C5T AKG 0.000003251 0.60139 3.94737
44 1QY1 PRZ 0.0007962 0.41853 4.02299
45 4JGP PYR 0.02679 0.40896 4.14747
46 5V1B 8UY 0.002521 0.46047 4.16667
47 1TZD ADP 0.008503 0.43236 4.36364
48 3W21 AKG 0.001961 0.46352 4.3956
49 3OYW TDG 0.0005954 0.49308 4.47761
50 1W6O LAT 0.01484 0.4239 4.47761
51 5ML3 DL3 0.004102 0.41756 4.69799
52 3KV5 OGA 0.008394 0.43884 4.77528
53 1Y2F WAI 0.01229 0.42656 5.03597
54 5AVF TAU 0.0224 0.40673 5.05837
55 1A78 TDG 0.0019 0.46817 5.22388
56 4J25 OGA 0.00004657 0.55225 5.24017
57 2WBV SIA 0.01575 0.43248 5.29101
58 2HKA C3S 0.006254 0.41088 5.38462
59 4H2V AMP 0.001896 0.42638 5.45455
60 4P7X AKG 0.007617 0.4105 5.47945
61 4P7X YCP 0.007617 0.4105 5.47945
62 4UWJ 7L5 0.02822 0.40041 5.61798
63 4UWJ MYA 0.02822 0.40041 5.61798
64 2XMY CDK 0.004646 0.43516 5.7047
65 3B00 16A 0.0153 0.41106 5.88235
66 5FWE OGA 0.005522 0.44475 5.89888
67 2YBP 2HG 0.00738 0.43842 5.89888
68 2OS2 OGA 0.007575 0.43785 5.89888
69 5LY2 OGA 0.008866 0.43126 5.89888
70 5F3I 5UJ 0.006314 0.4234 5.89888
71 1NKI PPF 0.01164 0.42584 5.92593
72 2Q8E OGA 0.007647 0.43758 5.96591
73 2Q8C AKG 0.009731 0.43098 5.96591
74 5FP3 3JI 0.002274 0.41962 6.17978
75 3VV1 GAL FUC 0.0004129 0.51317 6.25
76 4NPL AKG 0.000000223 0.45446 6.4
77 2FTB OLA 0.005267 0.41072 6.4
78 5AIG VPR 0.02325 0.402 6.4
79 5UQD AKG 0.007588 0.43893 6.46067
80 2ZWS PLM 0.02908 0.40107 6.74157
81 4OCT AKG 0.000001799 0.60536 6.75676
82 2CDO GAL AAL GAL AAL GAL AAL 0.007246 0.43312 6.875
83 2QX0 PH2 0.03097 0.40707 6.91824
84 5FWJ MMK 0.00132 0.46925 7.02247
85 1OIJ AKG 0.001162 0.46971 7.30897
86 1J3R 6PG 0.003637 0.44201 7.36842
87 5FU3 BGC BGC BGC 0.005602 0.4448 7.54717
88 2YNE YNE 0.03552 0.40423 7.58427
89 2YNE NHW 0.03552 0.40423 7.58427
90 4WVW SLT 0.003361 0.45277 7.63889
91 2YMZ LAT 0.001173 0.44548 7.69231
92 2VFT SOR 0.007194 0.42734 7.86517
93 5FPX GLY SER SER HIS HIS HIS HIS HIS 0.0001763 0.47936 7.9646
94 5TFZ 7BC 0.001648 0.46436 8
95 4RFR RHN 0.00007713 0.44614 8.37438
96 5M0T AKG 0.01401 0.42244 8.5034
97 2GC0 PAN 0.005864 0.41564 8.51064
98 4WOE ADP 0.01477 0.42134 8.70786
99 4QXB OGA 0.01377 0.41753 8.82353
100 2GMH UQ5 0.002797 0.41588 8.98876
101 4XBT 3ZQ 0.01536 0.40709 9.03226
102 4XBT FLC 0.01642 0.40206 9.03226
103 3PUR 2HG 0.008935 0.43412 9.26966
104 1OS7 AKG 0.002109 0.428 9.54064
105 1OS7 TAU 0.002109 0.428 9.54064
106 4H2X G5A 0.006576 0.40992 9.70874
107 1UPR 4IP 0.02103 0.42461 9.7561
108 1N5S ADL 0.004442 0.42492 9.82143
109 3MTX PGT 0.005544 0.40614 9.93377
110 2DDQ HRB 0.01469 0.41194 10.3286
111 1GT4 UNA 0.00383 0.42789 10.6918
112 1CBK ROI 0.03958 0.40014 11.25
113 5T7I LAT NAG GAL 0.01291 0.42499 12.2581
114 5HV0 AKG 0.00002842 0.44207 12.4424
115 4W9N TCL 0.01146 0.42618 13.5693
116 2AG4 OLA 0.004562 0.43118 14.0244
117 2AG4 LP3 0.005117 0.43118 14.0244
118 5KEW 6SB 0.004076 0.45293 15.9574
119 5LUN OGA 0.000000105 0.68822 16.1932
120 5LUN ARG 0.000009653 0.49996 16.1932
121 2BOS GLA GAL 0.007922 0.42279 17.6471
122 4CS9 AMP 0.0158 0.42139 17.9894
123 3HQR OGA 0.00001698 0.54985 29.4118
124 5L9B AKG 0.0000786 0.52432 36.8421
125 1ODM ASV 0.00001816 0.49716 37.1601
126 5C3R AKG 0.0000000003775 0.73993 38.7755
127 5C3R HMU 0.0000000003775 0.73993 38.7755
Pocket No.: 3; Query (leader) PDB : 1GP6; Ligand: SIN; Similar sites found: 201
This union binding pocket(no: 3) in the query (biounit: 1gp6.bio1) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3WG3 A2G GAL NAG FUC 0.002455 0.45559 None
2 1OFL NGK GCD 0.01339 0.41995 1.40449
3 2OVD DAO 0.03268 0.40433 1.64835
4 4YRD 3IT 0.002341 0.45136 1.68539
5 3PUA OGA 0.005621 0.4435 1.68539
6 2Z48 NGA 0.0132 0.43055 1.68539
7 2Z49 AMG 0.02417 0.40154 1.68539
8 1WNB BTL 0.00443 0.48002 1.96629
9 2OG7 SIN 0.002966 0.44604 1.96629
10 5IN3 G1P 0.02655 0.40597 1.96629
11 2Y0I AKG 0.03217 0.40157 1.98864
12 2WA4 069 0.001074 0.46297 2.00573
13 4B7E OGA 0.01926 0.41377 2.00573
14 2XUM OGA 0.01659 0.41127 2.00573
15 3P3N AKG 0.02612 0.40277 2.00573
16 3MF2 AMP 0.002798 0.41587 2.02312
17 2RDQ AKG 0.003792 0.4136 2.08333
18 4BXF AKG 0.0002095 0.52022 2.24719
19 4CCN OGA 0.003478 0.45106 2.24719
20 4CCK OGA 0.004998 0.44227 2.24719
21 4Y3O OGA 0.00568 0.44116 2.24719
22 4CCO OGA 0.01423 0.42126 2.24719
23 1ZX5 LFR 0.01659 0.44059 2.33333
24 3RGA LSB 0.002542 0.4361 2.4735
25 4HN1 TYD 0.003254 0.4444 2.48756
26 1I82 BGC BGC 0.02354 0.41171 2.6455
27 1RL4 BL5 0.02322 0.40383 2.65957
28 4OJ8 AKG 0.0008754 0.44453 2.73038
29 4OJ8 2TQ 0.002952 0.4149 2.73038
30 3AVR OGA 0.001562 0.47338 2.80899
31 3AVS OGA 0.002942 0.4516 2.80899
32 1OJJ GLC GAL 0.004168 0.44392 2.80899
33 2OVW CBI 0.009861 0.42492 2.80899
34 4AZI OAN 0.01396 0.41305 2.80899
35 3FW9 SLX 0.01002 0.4018 2.80899
36 2NZ2 CIR 0.03576 0.40021 2.80899
37 1NX4 AKG 0.004277 0.45246 2.9304
38 3W8X FTK 0.009386 0.41748 2.99145
39 3ACL 3F1 0.004428 0.42498 3.04054
40 1EPB REA 0.004104 0.4265 3.04878
41 3KFF XBT 0.002962 0.45682 3.08642
42 3KFF ZBT 0.002962 0.45682 3.08642
43 3X01 AMP 0.00722 0.4395 3.08989
44 4IE6 UN9 0.0001855 0.43888 3.08989
45 5A3T MMK 0.001284 0.43095 3.08989
46 5IQT AKG 0.004191 0.41509 3.08989
47 2JIG PD2 0.000001404 0.61985 3.125
48 3SAO DBH 0.02275 0.41331 3.125
49 3SAO NKN 0.0187 0.40672 3.125
50 5L9V OGA 0.0001054 0.51803 3.1746
51 4BQY FNT 0.00007388 0.49097 3.1746
52 3QRC SCR 0.000009845 0.57752 3.18471
53 4IAW LIZ 0.005634 0.4326 3.19149
54 2FCU AKG 0.0002881 0.51206 3.19489
55 1M6P M6P 0.0252 0.40824 3.28947
56 3H7J PPY 0.0009421 0.46071 3.29218
57 2IUW AKG 0.000001187 0.62355 3.36134
58 4IGQ OGA 0.0004805 0.4965 3.37079
59 4IGQ THR M3L GLN 0.0004492 0.46143 3.37079
60 1PIG GLC GLC 0.02464 0.414 3.37079
61 4ZU4 4TG 0.001298 0.44957 3.37838
62 4GJY OGA 0.00292 0.45399 3.40426
63 3HCH RSM 0.01613 0.42076 3.42466
64 3GL0 HXX 0.01474 0.40797 3.4384
65 4XCB HY0 0.0006835 0.43584 3.44828
66 4QM9 CYS 0.001765 0.46737 3.46821
67 2YG2 S1P 0.006811 0.40594 3.48837
68 2YG2 FLC 0.003225 0.40167 3.48837
69 2Z77 HE7 0.005941 0.40852 3.59712
70 2PNC CLU 0.005768 0.44414 3.65169
71 4M26 AKG 0.01454 0.42181 3.65169
72 4JZR 4JR 0.001147 0.47234 3.7037
73 5DG2 GAL GLC 0.0006892 0.46532 3.7037
74 2I74 MAN MAN MAN MAN 0.0322 0.40487 3.7037
75 2D6M LBT 0.001615 0.46493 3.77358
76 5BVE 4VG 0.02327 0.40171 3.93258
77 5C5T AKG 0.000003251 0.60139 3.94737
78 1QY1 PRZ 0.0007962 0.41853 4.02299
79 3BP1 GUN 0.02468 0.41062 4.13793
80 4JGP PYR 0.02679 0.40896 4.14747
81 5V1B 8UY 0.002521 0.46047 4.16667
82 2AXR ABL 0.02316 0.41175 4.21348
83 1TZD ADP 0.008503 0.43236 4.36364
84 3W21 AKG 0.001961 0.46352 4.3956
85 3O5N BR0 0.008239 0.42626 4.46429
86 3OYW TDG 0.0005954 0.49308 4.47761
87 2ET1 GLV 0.001701 0.47193 4.47761
88 1W6P NDG GAL 0.00276 0.45685 4.47761
89 1W6O LAT 0.01484 0.4239 4.47761
90 1GZW GAL BGC 0.01758 0.4195 4.47761
91 1SLT NDG GAL 0.03651 0.40378 4.47761
92 2P7Q GG6 0.03133 0.40324 4.51128
93 5ML3 DL3 0.004102 0.41756 4.69799
94 3KV5 OGA 0.008394 0.43884 4.77528
95 4QDF 30Q 0.01405 0.40178 4.77528
96 2A1X AKG 0.00001241 0.58184 4.87013
97 3W9F I3P 0.01784 0.43144 5
98 1Y2F WAI 0.01229 0.42656 5.03597
99 5AVF TAU 0.0224 0.40673 5.05837
100 1A78 TDG 0.0019 0.46817 5.22388
101 4J25 OGA 0.00004657 0.55225 5.24017
102 2WBV SIA 0.01575 0.43248 5.29101
103 2DIO EOD 0.006567 0.42092 5.31915
104 2HKA C3S 0.006254 0.41088 5.38462
105 4H2V AMP 0.001896 0.42638 5.45455
106 2VQ5 HBA 0.0307 0.40418 5.47264
107 4P7X YCP 0.007617 0.4105 5.47945
108 4P7X AKG 0.007617 0.4105 5.47945
109 1XNK XS2 0.01684 0.40515 5.61225
110 4UWJ 7L5 0.02822 0.40041 5.61798
111 4UWJ MYA 0.02822 0.40041 5.61798
112 2XMY CDK 0.004646 0.43516 5.7047
113 2XOC ADP 0.01941 0.41245 5.74713
114 3B00 16A 0.0153 0.41106 5.88235
115 3K4Z CBI 0.02444 0.40744 5.88235
116 5FWE OGA 0.005522 0.44475 5.89888
117 2YBP 2HG 0.00738 0.43842 5.89888
118 2OS2 OGA 0.007575 0.43785 5.89888
119 5LY2 OGA 0.008866 0.43126 5.89888
120 5F3I 5UJ 0.006314 0.4234 5.89888
121 3KV4 OGA 0.01828 0.41809 5.89888
122 1NKI PPF 0.01164 0.42584 5.92593
123 2Q8E OGA 0.007647 0.43758 5.96591
124 2Q8C AKG 0.009731 0.43098 5.96591
125 4NAO AKG 0.001172 0.47176 6.13497
126 5FP3 3JI 0.002274 0.41962 6.17978
127 3VV1 GAL FUC 0.0004129 0.51317 6.25
128 4L4J NAG NAG BMA MAN NAG 0.00009323 0.53605 6.33484
129 4NPL AKG 0.000000223 0.6791 6.4
130 5AIG VPR 0.02325 0.402 6.4
131 5UQD AKG 0.007588 0.43893 6.46067
132 1UUY PPI 0.01018 0.42666 6.58683
133 4MOB ADP 0.009358 0.43245 6.62651
134 2ZWS PLM 0.02908 0.40107 6.74157
135 4OCT AKG 0.000001799 0.60536 6.75676
136 2CDO GAL AAL GAL AAL GAL AAL 0.007246 0.43312 6.875
137 2QX0 PH2 0.03097 0.40707 6.91824
138 4LIT AKG 0.001202 0.47786 7.02247
139 5FWJ MMK 0.00132 0.46925 7.02247
140 1I7E IBS 0.01549 0.42109 7.16981
141 1OIJ AKG 0.001162 0.46971 7.30897
142 1OIK AKG 0.001942 0.46456 7.30897
143 1OIK C26 0.002399 0.43727 7.30897
144 1J3R 6PG 0.003637 0.44201 7.36842
145 5FU3 BGC BGC BGC 0.005602 0.4448 7.54717
146 2YNE NHW 0.03552 0.40423 7.58427
147 2YNE YNE 0.03552 0.40423 7.58427
148 4WVW SLT 0.003361 0.45277 7.63889
149 2YMZ LAT 0.001173 0.44548 7.69231
150 4GGZ BTN 0.01241 0.41558 7.82609
151 2VFT SOR 0.007194 0.42734 7.86517
152 5FPX GLY SER SER HIS HIS HIS HIS HIS 0.0001763 0.47936 7.9646
153 1RZM E4P 0.02767 0.41117 7.98817
154 5TFZ 7BC 0.001648 0.46436 8
155 4RFR RHN 0.00007713 0.44614 8.37438
156 3M94 M7M 0.01599 0.41362 8.46561
157 5M0T AKG 0.01401 0.42244 8.5034
158 2GC0 PAN 0.005864 0.41564 8.51064
159 4M1U A2G MBG 0.003536 0.45256 8.57143
160 4WOE ADP 0.01477 0.42134 8.70786
161 4H6B 10Y 0.003772 0.44123 8.71795
162 1C1L GAL BGC 0.001176 0.479 8.75912
163 4QXB OGA 0.01377 0.41753 8.82353
164 2GMH UQ5 0.002797 0.41588 8.98876
165 4XBT 3ZQ 0.01536 0.40709 9.03226
166 4XBT FLC 0.01642 0.40206 9.03226
167 3PUR 2HG 0.008935 0.43412 9.26966
168 1OS7 TAU 0.002109 0.428 9.54064
169 1OS7 AKG 0.002109 0.428 9.54064
170 1H2M OGA 0.01967 0.40704 9.61539
171 4H2X G5A 0.006576 0.40992 9.70874
172 1UPR 4IP 0.02103 0.42461 9.7561
173 1N5S ADL 0.004442 0.42492 9.82143
174 3MTX PGT 0.005544 0.40614 9.93377
175 2QL9 CIT 0.01701 0.41347 10.3093
176 2DDQ HRB 0.01469 0.41194 10.3286
177 1GT4 UNA 0.00383 0.42789 10.6918
178 4JH6 FCN 0.003156 0.45005 10.8696
179 2AGC DAO 0.02327 0.40588 11.1111
180 1CBK ROI 0.03958 0.40014 11.25
181 1ZZ7 S0H 0.01636 0.41808 11.6162
182 1NYW DAU 0.002169 0.43122 12.1827
183 1H2K OGA 0.01681 0.41076 12.1951
184 5T7I LAT NAG GAL 0.01291 0.42499 12.2581
185 5HV0 AKG 0.00002842 0.44207 12.4424
186 4W9N TCL 0.01146 0.42618 13.5693
187 3EW2 BTN 0.01023 0.4241 14.0741
188 3SCH TB6 0.002776 0.46318 14.6465
189 1ULE GLA GAL NAG 0.0002268 0.52637 14.6667
190 5KEW 6SB 0.004076 0.45293 15.9574
191 5LUN OGA 0.000000105 0.68822 16.1932
192 5LUN ARG 0.000009653 0.49996 16.1932
193 2BOS GLA GAL 0.007922 0.42279 17.6471
194 4CS9 AMP 0.0158 0.42139 17.9894
195 3HQR OGA 0.00001698 0.54985 29.4118
196 1UNB AKG 0.00001022 0.48423 34.4051
197 1UNB PN1 0.00001019 0.47078 34.4051
198 5L9B AKG 0.0000786 0.52432 36.8421
199 1ODM ASV 0.00001816 0.49716 37.1601
200 5C3R AKG 0.0000000003775 0.73993 38.7755
201 5C3R HMU 0.0000000003775 0.73993 38.7755
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