Receptor
PDB id Resolution Class Description Source Keywords
3GXO 2.3 Å NON-ENZYME: OTHER STRUCTURE OF THE MITOMYCIN 7-O-METHYLTRANSFERASE MMCR WITH B MITOMYCIN A STREPTOMYCES LAVENDULAE METHYLTRANSFERASE MITOMYCIN MMCR S-ADENOSYL METHIONINE TRANSFERASE
Ref.: STRUCTURAL CHARACTERIZATION OF THE MITOMYCIN 7-O-METHYLTRANSFERASE. PROTEINS V. 79 2181 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA D:352;
D:353;
Part of Protein;
Part of Protein;
none;
none;
submit data
40.078 Ca [Ca+2...
MQA A:351;
B:351;
C:351;
D:351;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
349.339 C16 H19 N3 O6 CC1=C...
SAH A:350;
B:350;
C:350;
D:350;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
384.411 C14 H20 N6 O5 S c1nc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3GXO 2.3 Å NON-ENZYME: OTHER STRUCTURE OF THE MITOMYCIN 7-O-METHYLTRANSFERASE MMCR WITH B MITOMYCIN A STREPTOMYCES LAVENDULAE METHYLTRANSFERASE MITOMYCIN MMCR S-ADENOSYL METHIONINE TRANSFERASE
Ref.: STRUCTURAL CHARACTERIZATION OF THE MITOMYCIN 7-O-METHYLTRANSFERASE. PROTEINS V. 79 2181 2011
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 3GXO - MQA C16 H19 N3 O6 CC1=C(C(=O....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1068 families.
1 3GXO - MQA C16 H19 N3 O6 CC1=C(C(=O....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 922 families.
1 3GXO - MQA C16 H19 N3 O6 CC1=C(C(=O....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: MQA; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 MQA 1 1
Ligand no: 2; Ligand: SAH; Similar ligands found: 197
No: Ligand ECFP6 Tc MDL keys Tc
1 SAH 1 1
2 5X8 0.759494 0.969697
3 A7D 0.734177 0.926471
4 TT8 0.709302 0.970588
5 SXZ 0.692308 0.916667
6 DSH 0.692308 0.914286
7 DTA 0.666667 0.857143
8 3DH 0.662338 0.869565
9 S8M 0.655556 0.901408
10 SFG 0.635294 0.954545
11 SA8 0.62069 0.915493
12 EEM 0.617977 0.890411
13 MTA 0.615385 0.869565
14 SAI 0.613636 0.955882
15 S7M 0.586957 0.916667
16 36A 0.586538 0.90411
17 K15 0.583333 0.878378
18 RAB 0.573333 0.84058
19 ADN 0.573333 0.84058
20 XYA 0.573333 0.84058
21 62X 0.572917 0.855263
22 5CD 0.571429 0.852941
23 0UM 0.5625 0.876712
24 5N5 0.558442 0.84058
25 A4D 0.551282 0.867647
26 SAM 0.537634 0.916667
27 SSA 0.536842 0.712644
28 SMM 0.536842 0.88
29 KB1 0.534653 0.902778
30 A5D 0.532609 0.857143
31 SIB 0.53125 0.928571
32 EP4 0.530864 0.819444
33 DSZ 0.530612 0.732558
34 GSU 0.53 0.752941
35 AMP 0.529412 0.763158
36 A 0.529412 0.763158
37 5CA 0.525773 0.712644
38 ME8 0.524752 0.8125
39 M2T 0.52439 0.821918
40 6RE 0.523256 0.824324
41 GJV 0.522727 0.813333
42 AAT 0.515789 0.863014
43 LSS 0.515152 0.696629
44 KAA 0.514852 0.727273
45 J7C 0.511364 0.835616
46 A5A 0.510417 0.697674
47 SON 0.505495 0.805195
48 SRP 0.505155 0.805195
49 5AL 0.5 0.779221
50 VMS 0.5 0.681818
51 KH3 0.5 0.866667
52 ADX 0.5 0.694118
53 CA0 0.5 0.769231
54 AMP MG 0.5 0.74359
55 AMO 0.5 0.805195
56 54H 0.5 0.681818
57 AHX 0.49505 0.753086
58 TSB 0.494949 0.689655
59 53H 0.494949 0.674157
60 G5A 0.494737 0.712644
61 A2D 0.494382 0.74359
62 ABM 0.494382 0.74359
63 ZAS 0.494253 0.808219
64 A6D 0.490196 0.759494
65 8QN 0.49 0.779221
66 GEK 0.49 0.956522
67 GAP 0.489583 0.769231
68 A3S 0.48913 0.884058
69 AN2 0.48913 0.734177
70 S4M 0.488889 0.831169
71 SRA 0.488636 0.746835
72 LAD 0.485437 0.810127
73 52H 0.484848 0.674157
74 A12 0.483516 0.759494
75 BA3 0.483516 0.74359
76 AP2 0.483516 0.759494
77 AOC 0.483146 0.842857
78 NEC 0.483146 0.788732
79 Y3J 0.481481 0.768116
80 NVA LMS 0.480392 0.696629
81 VRT 0.479167 0.861111
82 50T 0.478723 0.734177
83 5AS 0.478261 0.655556
84 B4P 0.478261 0.74359
85 ADP 0.478261 0.74359
86 AP5 0.478261 0.74359
87 A3N 0.477778 0.830986
88 YSA 0.476636 0.712644
89 XAH 0.476636 0.768293
90 0XU 0.473684 0.897059
91 WAQ 0.471154 0.807692
92 NSS 0.470588 0.712644
93 5AD 0.468354 0.791045
94 ADP MG 0.468085 0.734177
95 AU1 0.468085 0.725
96 M33 0.468085 0.734177
97 MAO 0.467391 0.797468
98 TXA 0.466667 0.759494
99 A3G 0.466667 0.871429
100 NB8 0.466667 0.775
101 3AM 0.465909 0.727273
102 DAL AMP 0.465347 0.779221
103 ATP 0.463158 0.74359
104 ADP BEF 0.463158 0.716049
105 A3T 0.463158 0.842857
106 BEF ADP 0.463158 0.716049
107 ACP 0.463158 0.746835
108 7D7 0.4625 0.785714
109 LEU LMS 0.461538 0.677778
110 APC 0.458333 0.759494
111 AQP 0.458333 0.74359
112 APR 0.458333 0.766234
113 PRX 0.458333 0.746835
114 AR6 0.458333 0.766234
115 5FA 0.458333 0.74359
116 IOT 0.456897 0.761905
117 4AD 0.456311 0.794872
118 PAJ 0.456311 0.722892
119 WSA 0.45614 0.72093
120 FA5 0.453704 0.805195
121 YAP 0.453704 0.794872
122 RBY 0.453608 0.782051
123 ADV 0.453608 0.782051
124 ADP PO3 0.453608 0.763158
125 AD9 0.453608 0.725
126 SAP 0.453608 0.728395
127 AGS 0.453608 0.728395
128 PTJ 0.45283 0.731707
129 MHZ 0.452632 0.797468
130 00A 0.451923 0.740741
131 A3P 0.451613 0.74026
132 YLP 0.451327 0.771084
133 7MD 0.45045 0.768293
134 ALF ADP 0.45 0.707317
135 ADP ALF 0.45 0.707317
136 ATP MG 0.44898 0.734177
137 2VA 0.447917 0.819444
138 OOB 0.446602 0.779221
139 ANP 0.444444 0.725
140 ACQ 0.444444 0.746835
141 TAT 0.444444 0.7375
142 P5A 0.443396 0.719101
143 7D5 0.443182 0.708861
144 ARG AMP 0.442478 0.759036
145 A1R 0.442308 0.7625
146 YLC 0.439655 0.790123
147 2AM 0.438202 0.717949
148 DLL 0.438095 0.779221
149 A22 0.436893 0.734177
150 D3Y 0.436893 0.859155
151 TYR AMP 0.436364 0.782051
152 ATF 0.435644 0.716049
153 MYR AMP 0.435185 0.746988
154 SO8 0.434343 0.808219
155 3UK 0.433962 0.769231
156 OAD 0.433962 0.769231
157 TAD 0.433628 0.765432
158 25A 0.432692 0.74359
159 ANP MG 0.431373 0.707317
160 VO4 ADP 0.431373 0.734177
161 ADP VO4 0.431373 0.734177
162 9SN 0.431193 0.731707
163 TYM 0.431034 0.805195
164 PR8 0.429907 0.8
165 ADQ 0.428571 0.746835
166 YLB 0.42735 0.771084
167 3OD 0.425926 0.769231
168 FYA 0.425926 0.779221
169 1ZZ 0.425926 0.746988
170 PPS 0.425743 0.674419
171 NVA 2AD 0.424242 0.808219
172 MAP 0.423077 0.707317
173 A2P 0.421053 0.727273
174 4YB 0.421053 0.735632
175 ADP BMA 0.420561 0.746835
176 5SV 0.419048 0.731707
177 3NZ 0.416667 0.824324
178 YLA 0.416667 0.771084
179 48N 0.413793 0.753086
180 LPA AMP 0.413793 0.768293
181 AYB 0.413223 0.761905
182 QQY 0.413043 0.696203
183 ACK 0.413043 0.710526
184 JB6 0.412844 0.7625
185 BIS 0.412844 0.719512
186 PAP 0.41 0.730769
187 OVE 0.408602 0.7125
188 4UV 0.40708 0.75
189 AMP DBH 0.40708 0.746835
190 3AD 0.406977 0.852941
191 AF3 ADP 3PG 0.40678 0.743902
192 OMR 0.40678 0.738095
193 LAQ 0.405172 0.768293
194 A A 0.40367 0.74359
195 7C5 0.403509 0.789474
196 7MC 0.403361 0.75
197 4UU 0.4 0.75
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3GXO; Ligand: MQA; Similar sites found: 41
This union binding pocket(no: 1) in the query (biounit: 3gxo.bio3) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5L7G 6QE 0.02405 0.40219 1.96721
2 1HG4 LPP 0.02409 0.40785 2.15054
3 1RE8 BD2 0.04857 0.40792 2.57143
4 4P53 NAI 0.01206 0.42469 2.71003
5 1NRL SRL 0.02049 0.40247 2.71003
6 1K7L 544 0.02286 0.40768 3.125
7 2B8T THM 0.02286 0.40172 3.13901
8 3KDU NKS 0.04626 0.41142 3.2491
9 1DB1 VDX 0.009537 0.43503 3.4749
10 3EBL GA4 0.02232 0.40225 3.52304
11 4A7W GTP 0.001135 0.46834 3.75
12 3L0E G58 0.02831 0.40422 3.79404
13 2HW2 RFP 0.02533 0.40104 4.1958
14 1KI6 AHU 0.009947 0.40316 4.33604
15 3EM0 CHD 0.03722 0.41345 4.34783
16 4RFR RHN 0.01611 0.40594 4.4335
17 3OLL EST 0.01478 0.40397 4.60705
18 3SVJ 4LI 0.0167 0.40861 5.41872
19 1DKF BMS 0.01865 0.40779 5.53191
20 5E7V M7E 0.01555 0.42029 5.66667
21 1SR7 MOF 0.02556 0.41144 5.79151
22 3FAL LO2 0.01432 0.42339 6.77507
23 1FCZ 156 0.02412 0.40364 6.77507
24 3V49 PK0 0.02129 0.40786 7.14286
25 2AX9 BHM 0.04923 0.40425 7.42188
26 1XAP TTB 0.01901 0.4041 8.61423
27 3KMZ EQO 0.02571 0.40505 8.64662
28 5CXI 5TW 0.01246 0.40763 8.86699
29 1I7M PUT 0.008021 0.41728 8.95522
30 2LBD REA 0.01197 0.42063 8.98876
31 3QFJ LEU LEU PHE GLY PHE PRO VAL TYR VAL 0.03887 0.41242 10
32 5K52 OCD 0.02363 0.401 10.5691
33 3E2M E2M 0.0243 0.40492 10.8108
34 4MGB XDH 0.01382 0.40737 11.3725
35 3UUD EST 0.01314 0.40441 11.5538
36 3BEJ MUF 0.01454 0.41326 14.2857
37 3TKY N7I 0.0006004 0.46115 27.3713
38 1FP1 HCC 0.000006902 0.57257 36.0434
39 1XDS DRA 0.001192 0.4028 36.3144
40 3P9C SAH 0.009373 0.43542 38.2114
41 1ZGA HMK 0.001395 0.44927 42.8184
Pocket No.: 2; Query (leader) PDB : 3GXO; Ligand: SAH; Similar sites found: 238
This union binding pocket(no: 2) in the query (biounit: 3gxo.bio3) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5X62 SAH 0.00004107 0.49227 0.813008
2 1ORR NAD 0.009092 0.42111 0.864553
3 2PT9 2MH 0.02321 0.40265 1.24611
4 2PT9 S4M 0.01445 0.40265 1.24611
5 4UCI SAM 0.0005371 0.45946 1.35501
6 2I7C AAT 0.02471 0.40134 1.41343
7 1UDB NAD 0.03862 0.4054 1.47929
8 2YY7 NAD 0.01988 0.40254 1.60256
9 3NDJ SAH 0.006533 0.44101 1.62602
10 3NDJ JHZ 0.006533 0.44101 1.62602
11 1R6D DAU 0.04543 0.40248 1.62602
12 1R6D NAD 0.04683 0.40248 1.62602
13 1EDO NAP 0.01049 0.41697 1.63934
14 2O07 MTA 0.008838 0.41542 1.64474
15 2O07 SPD 0.01005 0.41542 1.64474
16 3TKA SAM 0.007086 0.41063 1.72911
17 2DPM SAM 0.005171 0.41859 1.76056
18 1H8P PC 0.035 0.41059 1.83486
19 3NTD FAD 0.02977 0.40136 1.89702
20 4LWP SAH 0.004945 0.41401 1.90217
21 4FN4 NAD 0.01422 0.40827 1.9685
22 3S1S SAH 0.003736 0.42675 2.16802
23 1VDC FAD 0.02871 0.40972 2.16802
24 2P41 SAH 0.0006104 0.4548 2.29508
25 3GEG NAD 0.008401 0.41645 2.42915
26 5MPT SAH 0.0001568 0.46086 2.43902
27 5DNK SAH 0.0003337 0.4427 2.43902
28 1U2Z SAH 0.004679 0.42226 2.43902
29 1X87 NAD 0.01041 0.40628 2.43902
30 3ICT FAD 0.03009 0.40019 2.43902
31 1QAN SAH 0.004411 0.42175 2.45902
32 5XLX SAH 0.00009957 0.49013 2.48227
33 3EVG SAH 0.0003159 0.46763 2.54545
34 1JA9 NDP 0.01631 0.40781 2.55474
35 5E9W SAH 0.00006143 0.48189 2.5641
36 4GQB 0XU 0.0002539 0.48223 2.71003
37 1UWK NAD 0.005366 0.44438 2.71003
38 1UWK URO 0.005366 0.44438 2.71003
39 5FA5 MTA 0.001221 0.43685 2.71003
40 4RPL 3UC 0.03307 0.4176 2.71003
41 4RPL FAD 0.04715 0.40786 2.71003
42 2DTX BMA 0.02562 0.4055 2.71003
43 3Q9T FAY 0.02458 0.40544 2.71003
44 3FRH SAH 0.000001882 0.578 2.7668
45 1ZK4 NAP 0.01467 0.4144 2.78884
46 3LCV SAM 0.000002148 0.57537 2.84698
47 1JG3 ADN 0.001237 0.42326 2.98103
48 4YNU FAD 0.02531 0.4101 2.98103
49 4YNU LGC 0.02921 0.4101 2.98103
50 1IY8 NAD 0.01834 0.40422 2.98103
51 2WSB NAD 0.0265 0.40569 3.14961
52 2CFC NAD 0.01496 0.40598 3.2
53 2WA2 SAM 0.0009589 0.4438 3.26087
54 2BD0 NAP 0.01521 0.40927 3.27869
55 3B9Q MLI 0.01559 0.40571 3.31126
56 3LCC SAH 0.000004365 0.54818 3.40426
57 4TQG NDP 0.002138 0.44573 3.40557
58 3RKR NAP 0.003749 0.40037 3.43511
59 1SQF SAM 0.002 0.43168 3.4965
60 4M37 SAH 0.0008266 0.45101 3.49854
61 4M38 SAH 0.001194 0.44579 3.49854
62 4NBW NAD 0.01395 0.4061 3.50195
63 5FTW SAH 0.00002887 0.47539 3.51562
64 4N49 SAM 0.001056 0.4482 3.52304
65 1HDO NAP 0.01029 0.41968 3.52304
66 4HA6 FAD 0.02965 0.40585 3.52304
67 1LSS NAD 0.0111 0.40175 3.57143
68 2BGM NAJ 0.008556 0.41469 3.59712
69 1N2X SAM 0.003998 0.4254 3.65448
70 5KOK SAH 0.00001299 0.49401 3.79404
71 5KOK R9T 0.00003273 0.40469 3.79404
72 3QVP FAD 0.03835 0.40026 3.79404
73 2A14 SAH 0.0005068 0.46466 3.80228
74 1XCL SAH 0.009023 0.42009 3.82979
75 1G60 SAM 0.002241 0.43145 3.84615
76 1NFQ NAI 0.01666 0.40737 3.84615
77 2BZG SAH 0.001784 0.4339 3.87931
78 1WVG APR 0.0163 0.40021 3.89972
79 1R18 SAH 0.001296 0.44604 3.96476
80 4IEE AGS 0.005959 0.42334 4.06504
81 3T7S SAM 0.00001345 0.52913 4.10448
82 3MQ2 SAH 0.00001415 0.52542 4.12844
83 5JGL SAM 0.00004493 0.50305 4.15225
84 5GT9 NAP 0.02037 0.40204 4.18251
85 2ZWA SAH 0.00005572 0.5084 4.33604
86 4ONQ SFG 0.003192 0.42255 4.33604
87 2ZIF SAM 0.002232 0.43154 4.3771
88 3A4T SFG 0.004666 0.42064 4.37956
89 3O7W SAM 0.000001754 0.55418 4.42177
90 1I1N SAH 0.0001809 0.49439 4.42478
91 5ULP KB1 0.0008076 0.40424 4.47761
92 1P1C SAH 0.01128 0.40467 4.52261
93 3DXY SAM 0.00004324 0.48571 4.58716
94 3BXO SAM 0.000007062 0.52741 4.60705
95 3EYA FAD 0.0219 0.40492 4.60705
96 3GCZ SAM 0.0008313 0.44878 4.60993
97 1Q0S SAH 0.007858 0.41347 4.6332
98 4R6W PC 0.001132 0.48326 4.65116
99 4R6W SAH 0.000447 0.48211 4.65116
100 5MGZ SAH 0.000004824 0.50982 4.66102
101 3ELW SAM 0.001568 0.46681 4.66667
102 3ELW GP3 0.001645 0.46681 4.66667
103 1SB8 NAD 0.0278 0.41043 4.82955
104 1SB8 UD2 0.03175 0.41043 4.82955
105 1WY7 SAH 0.002012 0.43733 4.83092
106 2OBF F83 0.0007149 0.48455 4.84429
107 2VDV SAM 0.00000162 0.57186 4.87805
108 1L1E SAH 0.004416 0.41997 4.87805
109 1UAY ADN 0.003345 0.41169 4.95868
110 2EJU SAH 0.00747 0.40595 5.02645
111 2PWY SAH 0.002806 0.43246 5.03876
112 3G89 SAM 0.000005645 0.54729 5.14905
113 2JJQ SAH 0.00498 0.41375 5.14905
114 4QTU SAM 0.00005351 0.47017 5.18518
115 5E72 SAM 0.0008905 0.45349 5.20231
116 2PX8 SAH 0.002772 0.42531 5.20446
117 1KPH SAH 0.004906 0.41964 5.22648
118 5HJM MTA 0.0005461 0.43156 5.39773
119 3EVF GTA 0.004138 0.44418 5.41516
120 3EVF SAH 0.003546 0.44418 5.41516
121 4KRG SAH 0.00005448 0.49932 5.42005
122 3TLJ SAH 0.00007564 0.44047 5.42005
123 1ZPT FAD 0.02394 0.40601 5.42005
124 2EFJ SAH 0.00001755 0.52126 5.46875
125 1EJ0 SAM 0.001748 0.4343 5.55556
126 2ZFU SAH 0.00005851 0.50522 5.5814
127 3SSO SAH 0.008819 0.42914 5.69106
128 2Q1W NAD 0.02086 0.4027 5.70571
129 3LKZ SFG 0.001466 0.43978 5.919
130 2EG5 SAH 0.00003814 0.49718 5.96206
131 3QOX SAH 0.0001325 0.49328 5.96206
132 4EUE NAI 0.009028 0.42008 5.96206
133 4IWN GEK 0.00002454 0.52686 6.11354
134 4AZT SAM 0.000174 0.47925 6.23306
135 1XHL NDP 0.007553 0.42377 6.39731
136 4FZV SAM 0.01158 0.4009 6.40669
137 3GRU AMP 0.01124 0.40475 6.44068
138 4PIO AVI 0.0000499 0.52886 6.50155
139 4PIO SAH 0.0000537 0.52886 6.50155
140 3A4V NAD 0.0279 0.40082 6.50407
141 3O03 NAP 0.005362 0.42416 6.52921
142 5MW4 5JU 0.0006404 0.4847 6.58683
143 3QWI NAP 0.01955 0.40516 6.66667
144 3QWI CUE 0.03582 0.40092 6.66667
145 5XVK SAH 0.0001554 0.43524 6.69014
146 5XVQ SAH 0.0003105 0.42448 6.69014
147 5E8J SAH 0.00007363 0.49674 6.81818
148 1NW5 SAM 0.002396 0.43014 6.89655
149 3MB5 SAM 0.0008652 0.45591 7.04607
150 1Z3C SA8 0.0002916 0.48791 7.04698
151 3VC1 SAH 0.0001355 0.43192 7.05128
152 3U4C NDP 0.002898 0.43953 7.11744
153 4X7Y SAH 0.02406 0.40865 7.29927
154 1XSE NDP 0.02779 0.40466 7.45763
155 3ZV6 NAD 0.01049 0.42639 7.47331
156 3ZV6 4HB 0.01096 0.42639 7.47331
157 4NEC SAH 0.000009229 0.53078 7.57576
158 4PNE SAH 0.00003532 0.51961 7.58808
159 5BW4 SAM 0.0002153 0.47272 7.58808
160 3X0D SAH 0.002189 0.43191 7.85908
161 2JAH NDP 0.01404 0.40974 8.09717
162 3GDH SAH 0.0002548 0.41655 8.29876
163 3PFG TLO 0.00005672 0.53597 8.36502
164 3PFG SAM 0.003356 0.47871 8.36502
165 1F3L SAH 0.0009176 0.45289 8.41121
166 3FZG SAM 0.0007061 0.44738 8.5
167 5JJR SAH 0.001136 0.426 8.67209
168 5JAQ NAI 0.01663 0.41471 8.67209
169 4C4A SAH 0.00106 0.44612 8.94309
170 1NV8 MEQ 0.001673 0.44926 9.15493
171 1NV8 SAM 0.001799 0.44926 9.15493
172 3H2B SAH 0.0002936 0.4713 9.35961
173 5DWQ SFG 0.001546 0.44606 9.45559
174 5DX0 SFG 0.001771 0.44498 9.45559
175 1U7T TDT 0.01855 0.41422 9.57854
176 1DL5 SAH 0.0008693 0.46095 9.77918
177 1AE1 NAP 0.02321 0.40158 9.89011
178 1WG8 SAM 0.001546 0.44606 10.1754
179 4BLW SAH 0.003978 0.4302 10.3806
180 4BLW AMP 0.006272 0.42999 10.3806
181 3OU2 SAH 0.0000276 0.44787 10.5505
182 5F2K OCA 0.0005308 0.47857 10.5978
183 5F2K SAH 0.0005308 0.47857 10.5978
184 4KRI SAH 0.0000795 0.49918 10.8401
185 1RJD SAM 0.00001078 0.53854 11.0778
186 1TPY SAH 0.003477 0.42647 11.1111
187 5CUQ NSC 0.001288 0.46029 11.985
188 2AOT SAH 0.0001363 0.47901 12.6712
189 1JQD HSM 0.0001915 0.40766 12.6712
190 1JQD SAH 0.0001667 0.40034 12.6712
191 5F8F SFG 0.000047 0.49948 13.0081
192 1XKQ NDP 0.006101 0.42939 13.0081
193 3GU3 SAH 0.000002995 0.52803 13.0282
194 4OBW SAM 0.000322 0.4468 13.2296
195 1N7G NDP 0.03187 0.41954 13.2791
196 3BGD SAH 0.0008952 0.45523 13.4615
197 3BGD PM6 0.001261 0.45499 13.4615
198 5M58 SAH 0.000002855 0.56208 13.4783
199 5GM1 SAH 0.00002901 0.45653 13.8047
200 3P2E SAH 0.00003771 0.51387 14.2222
201 2HMT NAI 0.007239 0.41191 14.5833
202 5LOG SAH 0.004385 0.41828 14.5923
203 5T67 JHZ 0.006189 0.44131 14.6341
204 5T67 SAH 0.005465 0.4393 14.6341
205 2HNK SAH 0.007002 0.41087 14.6444
206 5FA8 SAM 0.0002394 0.42846 14.9068
207 4Y2H SAH 0.0004605 0.49052 15.4472
208 4Y2H 49K 0.0006864 0.4821 15.4472
209 3HVJ 705 0.01372 0.41683 16.2896
210 4XUC SAM 0.01229 0.41597 16.5138
211 4XUC 43G 0.01229 0.41597 16.5138
212 1I9G SAM 0.00899 0.40592 17.1429
213 3FUU ADN 0.005538 0.41369 17.7122
214 1IM8 SAI 0.0006264 0.4585 19.2623
215 5E1M PRO PRO LYS ARG ILE ALA 0.0009869 0.46843 20.7469
216 5E1M SAH 0.0009869 0.46843 20.7469
217 1XTP SAI 0.0006 0.45514 23.2283
218 1BC5 SAH 0.000243 0.4812 24.1636
219 1L3I SAH 0.003546 0.43253 25
220 5BXV MGP 0.0125 0.40656 25
221 5DX1 SFG 0.00103 0.45589 26.3158
222 5DXA SFG 0.001402 0.40063 26.3158
223 5DX8 SFG 0.001344 0.40019 26.3158
224 3TKY SAH 0.00000000002505 0.79023 27.3713
225 1KYZ FER 0.0000001332 0.64072 30.3523
226 1KYZ SAH 0.00000005065 0.63784 30.3523
227 4M73 M72 0.00007619 0.52583 30.8605
228 4M73 SAH 0.0000714 0.52581 30.8605
229 4KIB SAH 0.00008098 0.49165 33.0532
230 1FP1 SAH 0.000000000946 0.7074 36.0434
231 1XDS SAM 0.00000000006731 0.77043 36.3144
232 1QZZ SAM 0.0000000005947 0.70202 37.1274
233 3P9C SAH 0.00000005766 0.66667 38.2114
234 4A6D SAM 0.0000000003112 0.74086 38.5269
235 1ZGA SAH 0.0000003829 0.58299 42.8184
236 3LST SAH 0.00000000001818 0.79619 43.9655
237 3I53 SAH 0.00000000009326 0.76827 46.988
238 4E70 N7I 0.0000000003418 0.5633 47.4255
Pocket No.: 3; Query (leader) PDB : 3GXO; Ligand: SAH; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 3gxo.bio3) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3GXO; Ligand: MQA; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 3gxo.bio3) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 3GXO; Ligand: SAH; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 3gxo.bio3) has 18 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 3GXO; Ligand: MQA; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 3gxo.bio3) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 3GXO; Ligand: MQA; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 3gxo.bio3) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 3GXO; Ligand: SAH; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 3gxo.bio3) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 3GXO; Ligand: MQA; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 3gxo.bio1) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 10; Query (leader) PDB : 3GXO; Ligand: MQA; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 10) in the query (biounit: 3gxo.bio1) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 11; Query (leader) PDB : 3GXO; Ligand: SAH; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 11) in the query (biounit: 3gxo.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 12; Query (leader) PDB : 3GXO; Ligand: SAH; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 12) in the query (biounit: 3gxo.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 13; Query (leader) PDB : 3GXO; Ligand: MQA; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 13) in the query (biounit: 3gxo.bio2) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 14; Query (leader) PDB : 3GXO; Ligand: SAH; Similar sites found: 96
This union binding pocket(no: 14) in the query (biounit: 3gxo.bio2) has 18 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1G0N NDP 0.02032 0.41283 1.06007
2 1G0N PHH 0.03172 0.40583 1.06007
3 1G55 SAH 0.0007279 0.41832 1.16618
4 1GY8 NAD 0.007355 0.42689 1.62602
5 1I8T FAD 0.009914 0.42935 1.63488
6 1XHC FAD 0.0261 0.40545 1.90736
7 1GTE FAD 0.04855 0.40838 2.16802
8 1PN0 FAD 0.03729 0.40705 2.16802
9 1PN0 IPH 0.03854 0.40705 2.16802
10 4BUZ NAD 0.01135 0.41391 2.43902
11 4BUZ OAD 0.01361 0.41391 2.43902
12 4BUZ OCZ 0.01361 0.41391 2.43902
13 1YC5 NCA 0.01358 0.41018 2.43902
14 3ICR FAD 0.0294 0.40385 2.43902
15 2AE2 NAP 0.03327 0.40391 2.69231
16 3OFK SAH 0.003888 0.40539 2.77778
17 3RIY NAD 0.01255 0.4144 2.9304
18 4ITU NAI 0.01077 0.42122 2.97398
19 4ITU 1HS 0.01637 0.42122 2.97398
20 2C31 ADP 0.02509 0.42875 2.98103
21 2C31 TZD 0.02568 0.42875 2.98103
22 3G5S FAD 0.01351 0.42068 2.98103
23 3V1U NAD 0.01397 0.40684 2.98103
24 4POO SAM 0.0122 0.40818 3
25 3OID NDP 0.02035 0.40766 3.10078
26 2NXE SAM 0.002838 0.40389 3.25203
27 4O67 1SY 0.0161 0.40097 3.30579
28 4NBT NAD 0.02102 0.4023 3.33333
29 2XYQ SAH 0.00406 0.42193 3.44828
30 1V59 FAD 0.01922 0.42023 3.52304
31 3NUG NAD 0.02211 0.40363 3.52304
32 3E1T FAD 0.03916 0.40284 3.52304
33 2HQM FAD 0.04091 0.40105 3.52304
34 4V3C C 0.009574 0.40084 3.52304
35 1S7G APR 0.02013 0.4079 3.55731
36 3SJ7 NDP 0.02031 0.40302 3.57143
37 2EWM NAD 0.006634 0.42906 3.61446
38 5KOK S9T 0.000008806 0.40702 3.79404
39 2RAB FAD 0.03958 0.40341 3.79404
40 4M52 FAD 0.04067 0.40118 3.79404
41 3CH6 311 0.02498 0.42423 3.84615
42 3CH6 NAP 0.02498 0.42423 3.84615
43 3HDY GDU 0.01844 0.43178 4.06504
44 3HDY FDA 0.01794 0.43178 4.06504
45 3PT9 SAH 0.002565 0.4311 4.06504
46 1FEC FAD 0.01392 0.42819 4.06504
47 3HDY FAD 0.02635 0.42301 4.06504
48 4GKV NAD 0.0276 0.40221 4.16667
49 4ZA2 NAD 0.007874 0.42288 4.34783
50 5K7U SAM 0.001747 0.41175 4.60705
51 2FK8 SAM 0.001899 0.40403 4.60705
52 1E6E FAD 0.02099 0.41015 4.6875
53 1BXK NAD 0.01423 0.4105 4.78873
54 2GDZ NAD 0.01527 0.41026 4.86891
55 2IVF MGD 0.0303 0.40414 5.14905
56 4LH0 GLV 0.0327 0.40057 5.14905
57 1KPG SAH 0.001159 0.40145 5.22648
58 1O97 AMP 0.01526 0.43214 5.30303
59 5ITV NAI 0.02478 0.40122 5.4902
60 1O5I NAD 0.007453 0.41165 5.62249
61 5IL1 SAM 0.002495 0.40462 5.66667
62 1EU1 MGD 0.0288 0.40429 5.69106
63 1PS9 FAD 0.03971 0.40087 5.69106
64 1ZEM NAD 0.01733 0.40374 5.72519
65 4K26 SFF 0.01991 0.41422 5.7971
66 4K26 NDP 0.01596 0.41055 5.7971
67 2Q28 ADP 0.002523 0.43341 5.96206
68 4DCM SAM 0.002933 0.42419 5.96206
69 3C6K MTA 0.01302 0.42044 5.96206
70 3C6K SPD 0.01302 0.42044 5.96206
71 3LAD FAD 0.03167 0.40671 5.96206
72 1FFU CDP 0.01707 0.41661 6.13497
73 2Q0L FAD 0.03889 0.40133 6.23306
74 2PZM UDP 0.01988 0.41783 6.36364
75 2PZM NAD 0.01988 0.41783 6.36364
76 2WK1 SAH 0.009602 0.40829 6.73759
77 1OC2 NAD 0.04904 0.40568 6.89655
78 3TN7 NJP 0.01231 0.41602 7.393
79 1DUG GSH 0.02764 0.40321 7.69231
80 5GWX SAM 0.0004593 0.40266 8.09859
81 5GWX SAR 0.0004593 0.40266 8.09859
82 2CDU FAD 0.02607 0.40547 8.40108
83 3GD4 NAD 0.03655 0.42157 8.41487
84 3GD4 FAD 0.02585 0.42157 8.41487
85 1JV1 UD1 0.02277 0.40183 8.67209
86 2DKN NAI 0.02303 0.40037 9.01961
87 2ZWI C5P 0.004176 0.4052 9.21409
88 4CQM NAP 0.02343 0.40122 9.42623
89 4O0L NDP 0.01105 0.41831 10.1818
90 1ZQ9 SAM 0.01014 0.40362 10.5263
91 3EGI ADP 0.0009722 0.41696 11.165
92 4J1Q NDP 0.01414 0.40933 11.9241
93 4NTD FAD 0.01726 0.41637 15.5882
94 2F5Z FAD 0.04108 0.40178 15.625
95 4II2 ATP 0.0142 0.40036 20.4819
96 1FP2 SAH 0.000001644 0.4097 42.2764
Pocket No.: 15; Query (leader) PDB : 3GXO; Ligand: SAH; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 15) in the query (biounit: 3gxo.bio2) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 16; Query (leader) PDB : 3GXO; Ligand: MQA; Similar sites found: 20
This union binding pocket(no: 16) in the query (biounit: 3gxo.bio2) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4O4K 2PK 0.04832 0.41255 1.78571
2 1ZDU P3A 0.02038 0.41025 2.04082
3 1ZH8 NAP 0.02698 0.4066 2.05882
4 5X1M THG 0.03266 0.40584 2.43902
5 5X1M DHB 0.03248 0.40481 2.43902
6 1G2N EPH 0.01633 0.41226 3.78788
7 3EWC MCF 0.02326 0.40589 3.79404
8 1JL0 PUT 0.007242 0.40456 3.89222
9 3KP6 SAL 0.01712 0.40281 3.97351
10 4OAR 2S0 0.02039 0.40257 5.81395
11 2C0U FAD NBT 0.04941 0.40236 5.96206
12 1ZDT PEF 0.02127 0.40788 6.639
13 4G28 0W8 0.008965 0.40531 7.84314
14 3ET1 ET1 0.01993 0.40133 8.40108
15 4DM8 REA 0.007743 0.42538 8.61423
16 3RDE OYP 0.0191 0.40726 10.0271
17 3POT TP7 0.03388 0.40925 10.0402
18 4ZOM 4Q3 0.0411 0.40668 10.6667
19 2OKL BB2 0.01871 0.40086 10.8108
20 4M73 M72 0.04498 0.40457 30.8605
Feedback