Receptor
PDB id Resolution Class Description Source Keywords
5MGZ 1.9 Å EC: 2.1.1.284 STREPTOMYCES SPHEROIDES NOVO (8-DEMETHYLNOVBIOCIC ACID METHYLTRANSFERASE) WITH SAH STREPTOMYCES NIVEUS C METHYLTRANSFERASE NOVOBIOCIN BIOSYNTHESIS SAM DEPENDENTTRANSFERASE
Ref.: STRUCTURAL AND FUNCTIONAL BASIS OF C-METHYLATION OF SCAFFOLDS BY NOVO. ACS CHEM. BIOL. V. 12 374 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACT A:303;
Invalid;
none;
submit data
59.044 C2 H3 O2 CC(=O...
SAH A:301;
B:301;
Valid;
Valid;
none;
none;
submit data
384.411 C14 H20 N6 O5 S c1nc(...
GOL A:302;
Invalid;
none;
submit data
92.094 C3 H8 O3 C(C(C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5MGZ 1.9 Å EC: 2.1.1.284 STREPTOMYCES SPHEROIDES NOVO (8-DEMETHYLNOVBIOCIC ACID METHYLTRANSFERASE) WITH SAH STREPTOMYCES NIVEUS C METHYLTRANSFERASE NOVOBIOCIN BIOSYNTHESIS SAM DEPENDENTTRANSFERASE
Ref.: STRUCTURAL AND FUNCTIONAL BASIS OF C-METHYLATION OF SCAFFOLDS BY NOVO. ACS CHEM. BIOL. V. 12 374 2017
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5MGZ - SAH C14 H20 N6 O5 S c1nc(c2c(n....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5MGZ - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 5M58 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5MGZ - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 5M58 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; 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 : 5MGZ; Ligand: SAH; Similar sites found: 420
This union binding pocket(no: 1) in the query (biounit: 5mgz.bio1) has 22 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2PXX SAH 0.0000006229 0.57007 0.930233
2 5MPT SAH 0.000004822 0.52626 1.27119
3 1G55 SAH 0.00005317 0.48841 1.27119
4 4XUC SAM 0.0005672 0.46647 1.37615
5 4XUC 43G 0.0005672 0.46647 1.37615
6 2YY7 NAD 0.003617 0.42653 1.69492
7 2WPB ZZI 0.01781 0.40985 1.69492
8 3D3W NAP 0.01495 0.40134 1.69492
9 1U1I NAD 0.01592 0.40121 1.69492
10 1M2K APR 0.01134 0.40057 1.69492
11 1PR9 NAP 0.01572 0.40036 1.69492
12 1ORR NAD 0.0021 0.43965 2.11864
13 3CH6 NAP 0.01342 0.4253 2.11864
14 3CH6 311 0.01342 0.4253 2.11864
15 4D7E FAD 0.006087 0.42233 2.11864
16 4YNU FAD 0.01261 0.41551 2.11864
17 4YNU LGC 0.0148 0.41551 2.11864
18 1RKX NAD 0.009163 0.40854 2.11864
19 3UCL FAD 0.03443 0.40718 2.11864
20 3UCL CYH 0.03443 0.40718 2.11864
21 3UCL NAP 0.03723 0.40718 2.11864
22 1AE1 NAP 0.01248 0.40489 2.11864
23 3HVJ 705 0.0007442 0.46493 2.26244
24 3VSE SAH 0.00000453 0.49498 2.54237
25 4RPL FAD 0.006523 0.44176 2.54237
26 4RPL 3UC 0.008858 0.43719 2.54237
27 4RDH AMP 0.002158 0.43219 2.54237
28 2Z3Y F2N 0.006428 0.42824 2.54237
29 1XSE NDP 0.008477 0.41986 2.54237
30 4RDI ATP 0.002248 0.41571 2.54237
31 1DMR PGD 0.02769 0.41297 2.54237
32 1EU1 MGD 0.01123 0.41128 2.54237
33 4FC7 NAP 0.01578 0.40922 2.54237
34 4FC7 COA 0.01578 0.40922 2.54237
35 2ZFU SAH 0.000008237 0.52519 2.7907
36 3G2O SAM 0.00000003308 0.61432 2.9661
37 2EJU SAH 0.00002005 0.5119 2.9661
38 5ULP KB1 0.00008525 0.48828 2.9661
39 3EVG SAH 0.00009989 0.48178 2.9661
40 2YX1 SFG 0.00001896 0.47861 2.9661
41 2DPM SAM 0.0001179 0.47816 2.9661
42 3GRU AMP 0.0002128 0.46918 2.9661
43 3LKZ SFG 0.0002911 0.45719 2.9661
44 2E5V FAD 0.00613 0.4292 2.9661
45 4OPC PGT 0.02651 0.42823 2.9661
46 4OPC FDA 0.02338 0.42823 2.9661
47 5HSA FAS 0.007924 0.42217 2.9661
48 3ML1 MGD 0.02136 0.42019 2.9661
49 5G3U FDA 0.007751 0.41966 2.9661
50 2PX8 SAH 0.00205 0.41665 2.9661
51 1N4W FAD 0.01208 0.41551 2.9661
52 2Q7V FAD 0.01384 0.41096 2.9661
53 3VYW SAM 0.003384 0.40695 2.9661
54 5KMS NAD 0.03182 0.40523 2.9661
55 3LXD FAD 0.01493 0.40356 2.9661
56 5EZ7 FAD 0.01871 0.40306 2.9661
57 4D79 ATP 0.004956 0.40156 2.9661
58 5E8J SAH 0.000004935 0.55848 3.38983
59 5FTW SAH 0.000005622 0.51964 3.38983
60 1DL5 SAH 0.00005723 0.49963 3.38983
61 5XVQ SAH 0.000007033 0.49682 3.38983
62 5E9W SAH 0.000005328 0.4949 3.38983
63 3NDJ SAH 0.0002901 0.49374 3.38983
64 3NDJ JHZ 0.0002901 0.49374 3.38983
65 4C4A SAH 0.0000672 0.48411 3.38983
66 4BLW AMP 0.0002994 0.47895 3.38983
67 4N49 SAM 0.0001679 0.46949 3.38983
68 4BLW SAH 0.0003503 0.46526 3.38983
69 3FUU ADN 0.0002125 0.46296 3.38983
70 3S1S SAH 0.0004197 0.45649 3.38983
71 2PT9 2MH 0.001263 0.45084 3.38983
72 2PT9 S4M 0.0008781 0.44618 3.38983
73 2JB2 PHE 0.004441 0.43278 3.38983
74 2JB2 FAD 0.00422 0.43278 3.38983
75 1I8T FAD 0.005145 0.42884 3.38983
76 1RSG FAD 0.006019 0.42864 3.38983
77 2IV2 MGD 0.005086 0.42587 3.38983
78 1H82 FAD 0.01145 0.42526 3.38983
79 1H82 GZZ 0.01345 0.42526 3.38983
80 1YY5 FAD 0.008098 0.42448 3.38983
81 1BXK NAD 0.003506 0.42443 3.38983
82 1YQZ FAD 0.01539 0.42113 3.38983
83 1QO8 FAD 0.009341 0.4198 3.38983
84 3AB1 FAD 0.01172 0.41337 3.38983
85 1FEC FAD 0.01713 0.41094 3.38983
86 1PN0 FAD 0.01781 0.41093 3.38983
87 1PN0 IPH 0.0185 0.41093 3.38983
88 1GPE FAD 0.02363 0.40355 3.38983
89 4BV6 FAD 0.02163 0.40197 3.38983
90 4NTC FAD 0.02355 0.40025 3.38983
91 3DUW SAH 0.002241 0.41969 3.58744
92 5L95 AMP 0.001878 0.42294 3.75
93 2EG5 SAH 0.0000005104 0.60397 3.81356
94 5XVK SAH 0.000002706 0.55073 3.81356
95 1JQ3 AAT 0.000463 0.46908 3.81356
96 3GCZ SAM 0.0001165 0.46813 3.81356
97 2ZWA SAH 0.000145 0.45569 3.81356
98 1I9G SAM 0.0005877 0.44634 3.81356
99 4YAG NAI 0.003622 0.43884 3.81356
100 1GY8 NAD 0.003124 0.42936 3.81356
101 1IY8 NAD 0.003639 0.42641 3.81356
102 1Y8Q ATP 0.0005812 0.41986 3.81356
103 1KEW NAD 0.01449 0.41747 3.81356
104 3KLJ FAD 0.006783 0.4168 3.81356
105 1V59 FAD 0.01278 0.41609 3.81356
106 4II2 ATP 0.00211 0.41548 3.81356
107 5TTJ FAD 0.01026 0.41507 3.81356
108 1BZL FAD 0.04164 0.41501 3.81356
109 4REP FAD 0.01157 0.41268 3.81356
110 5U8U FAD 0.02762 0.41188 3.81356
111 3GDN HBX 0.02133 0.4095 3.81356
112 3GDN FAD 0.01557 0.4095 3.81356
113 2WET FAD 0.01568 0.40845 3.81356
114 1EK6 NAI 0.02696 0.40605 3.81356
115 3EYA FAD 0.01487 0.40364 3.81356
116 2CUL FAD 0.006503 0.41993 3.87931
117 5DX1 SFG 0.0000319 0.50877 4.23729
118 5DWQ SFG 0.00004488 0.50033 4.23729
119 5DX8 SFG 0.00004228 0.49938 4.23729
120 5DX0 SFG 0.00005901 0.49715 4.23729
121 5DXA SFG 0.0000428 0.46958 4.23729
122 4YUW S4M 0.006221 0.4587 4.23729
123 4YUW 4JU 0.006637 0.4577 4.23729
124 2WA2 SAM 0.000268 0.44743 4.23729
125 4UCI SAM 0.0006555 0.44228 4.23729
126 1O97 AMP 0.008698 0.43097 4.23729
127 1O97 FAD 0.008698 0.43097 4.23729
128 5M67 NAD 0.007333 0.42989 4.23729
129 5M67 ADE 0.008319 0.42731 4.23729
130 5M67 3D1 0.008605 0.42662 4.23729
131 5MBX FAD 0.0158 0.41787 4.23729
132 5MBX SP5 0.0158 0.41787 4.23729
133 5EB4 FAD 0.01189 0.41309 4.23729
134 4CNK FAD 0.01134 0.41209 4.23729
135 2V3V MGD 0.03204 0.41201 4.23729
136 3U31 NAD 0.00225 0.40788 4.23729
137 3UOY NAP 0.04333 0.40337 4.23729
138 3UOY FAD 0.04333 0.40337 4.23729
139 4RL4 PPV 0.009401 0.42262 4.24528
140 5JCM NAD 0.04732 0.40092 4.43459
141 5JCM FAD 0.04732 0.40092 4.43459
142 5JCM ISD 0.04975 0.40092 4.43459
143 3I53 SAH 0.000001792 0.55336 4.51807
144 2A14 SAH 0.000003904 0.54148 4.66102
145 1WG8 SAM 0.00002147 0.51418 4.66102
146 3GXO SAH 0.000004824 0.50982 4.66102
147 3GWZ SAH 0.000003294 0.50834 4.66102
148 3DMH SAM 0.0000485 0.49243 4.66102
149 3DMH GMP 0.00009189 0.49243 4.66102
150 1YXM ADE 0.001786 0.46846 4.66102
151 1X87 NAD 0.0003879 0.45796 4.66102
152 5FJN FAD 0.004676 0.43371 4.66102
153 5FJN BE2 0.005361 0.43371 4.66102
154 2EFJ SAH 0.005148 0.42882 4.66102
155 3OND ADN 0.007566 0.42843 4.66102
156 3OND NAD 0.007566 0.42843 4.66102
157 1ZEM NAD 0.003544 0.42134 4.66102
158 2CDU FAD 0.008349 0.4161 4.66102
159 2WSB NAD 0.01101 0.41463 4.66102
160 3CTY FAD 0.01373 0.41378 4.66102
161 4J36 FAD 0.01695 0.40106 4.66102
162 4J36 1HR 0.02464 0.40106 4.66102
163 4POO SAM 0.0003785 0.46028 5
164 5HJM MTA 0.000002697 0.54316 5.08475
165 4Y2H 49K 0.00004241 0.52417 5.08475
166 4Y2H SAH 0.00005777 0.51803 5.08475
167 3PT9 SAH 0.00005769 0.48033 5.08475
168 3A4T SFG 0.00004247 0.47639 5.08475
169 2IVF MGD 0.002507 0.44206 5.08475
170 4MIG G3F 0.006393 0.43269 5.08475
171 2HQM FAD 0.007702 0.42368 5.08475
172 4HXY NDP 0.004796 0.42107 5.08475
173 3ZNN 4WL 0.01701 0.41771 5.08475
174 3ZNN FAD 0.01701 0.41771 5.08475
175 4Z24 FAD 0.01367 0.41212 5.08475
176 2BD0 NAP 0.003497 0.42847 5.32787
177 3LCV SAM 0.00000549 0.53751 5.50847
178 4PIO AVI 0.00003404 0.51985 5.50847
179 4PIO SAH 0.00003685 0.51985 5.50847
180 4DMG SAM 0.0001114 0.50201 5.50847
181 1U2Z SAH 0.00009202 0.48485 5.50847
182 3A27 SAM 0.00006972 0.47771 5.50847
183 1NW5 SAM 0.000377 0.45244 5.50847
184 4RSL FAD 0.002213 0.44227 5.50847
185 4EUE NAI 0.002913 0.43202 5.50847
186 5O4J 9KH 0.005111 0.42351 5.50847
187 5O4J SAH 0.005111 0.42351 5.50847
188 4MO2 FDA 0.006107 0.42335 5.50847
189 4MO2 FAD 0.006598 0.42286 5.50847
190 5O4J PJL 0.00542 0.42118 5.50847
191 2R4J 13P 0.0203 0.41125 5.50847
192 2R4J FAD 0.0203 0.41125 5.50847
193 2V6G NAP 0.008032 0.41109 5.50847
194 5CGM MAL 0.009913 0.40977 5.50847
195 4X60 SFG 0.00001425 0.40629 5.50847
196 4X60 3XV 0.00001526 0.40175 5.50847
197 1XCL SAH 0.0003043 0.47581 5.53191
198 5F2K SAH 0.00005869 0.5077 5.9322
199 5F2K OCA 0.00005869 0.5077 5.9322
200 3O7W SAM 0.00002581 0.47641 5.9322
201 4TQG NDP 0.0007227 0.45468 5.9322
202 1EFV FAD 0.004852 0.4438 5.9322
203 5ITV NAI 0.002056 0.43745 5.9322
204 1EFV AMP 0.007054 0.43603 5.9322
205 2VVM FAD 0.005386 0.42893 5.9322
206 5BUK FAD 0.01052 0.41918 5.9322
207 1XTP SAI 0.000004237 0.52773 6.29921
208 1XDS SAM 0.000001006 0.59037 6.35593
209 3BGD SAH 0.00002515 0.47789 6.35593
210 3A25 SAM 0.00008461 0.47459 6.35593
211 1QAN SAH 0.00008245 0.46434 6.35593
212 2P41 SAH 0.0001746 0.46103 6.35593
213 3BGD PM6 0.00003835 0.44497 6.35593
214 4FN4 NAD 0.001845 0.43816 6.35593
215 1ELI PYC 0.005643 0.42597 6.35593
216 5J60 FAD 0.008648 0.41946 6.35593
217 3E1T FAD 0.01557 0.41037 6.35593
218 3Q87 SAM 0.002116 0.42626 6.4
219 2BZG SAH 0.00001539 0.5047 6.46552
220 1P1C SAH 0.0001921 0.47109 6.53266
221 5X62 SAH 0.0000006444 0.58362 6.77966
222 2UYQ SAM 0.00006918 0.53916 6.77966
223 5T67 SAH 0.0003578 0.48299 6.77966
224 5T67 JHZ 0.000469 0.48299 6.77966
225 3QWI NAP 0.01425 0.40229 6.77966
226 2V3A FAD 0.01978 0.40099 6.77966
227 2V3B FAD 0.01975 0.40005 6.77966
228 1SQL GUN 0.03225 0.40222 6.84932
229 3FRH SAH 0.00000809 0.53027 7.20339
230 4ONQ SFG 0.0000386 0.49961 7.20339
231 5XLX SAH 0.0004825 0.44276 7.20339
232 2XVE FAD 0.01958 0.41672 7.20339
233 4HA6 FAD 0.01547 0.4105 7.20339
234 5D4V SAH 0.005258 0.40755 7.20339
235 2XVF FAD 0.01369 0.40735 7.20339
236 1BC5 SAH 0.00003898 0.50089 7.62712
237 1RJD SAM 0.0001005 0.47897 7.62712
238 4E70 N7I 0.0003499 0.47013 7.62712
239 3SQP FAD 0.04944 0.42673 7.62712
240 1Q9I FAD 0.01496 0.42039 7.62712
241 1Q9I TEO 0.01496 0.42039 7.62712
242 2RAB FAD 0.02373 0.40265 7.62712
243 2RAB NAD 0.04366 0.40265 7.62712
244 5UAO FAD 0.02045 0.40221 7.62712
245 3IHG FAD 0.01256 0.40118 7.62712
246 3JUT GTQ 0.0155 0.43604 7.69231
247 3L9W AMP 0.0003721 0.47045 7.74818
248 3L9W GSH 0.000943 0.44959 7.74818
249 2FKA BEF 0.008607 0.41697 7.75194
250 2PWY SAH 0.02389 0.40642 7.75194
251 5N5D SAM 0.002003 0.42175 7.9646
252 2VDV SAM 0.00000003038 0.66053 8.05085
253 1FP2 SAH 0.003579 0.43165 8.05085
254 2WPF FAD 0.04337 0.41369 8.05085
255 3OFK SAH 0.000001539 0.53218 8.33333
256 1KYZ SAH 0.0008244 0.42825 8.47458
257 4ITU NAI 0.004452 0.42501 8.47458
258 4ITU 1HS 0.007207 0.42501 8.47458
259 3ABI NAD 0.004687 0.42021 8.47458
260 3C6K MTA 0.003596 0.4327 8.66142
261 3C6K SPD 0.003596 0.4327 8.66142
262 1QZZ SAM 0.000001308 0.5851 8.8983
263 3TKY SAH 0.000009251 0.52052 8.8983
264 2IID FAD 0.01157 0.42433 8.8983
265 2IID PHE 0.01157 0.42433 8.8983
266 5CUQ NSC 0.0001071 0.49604 8.98876
267 3TLJ SAH 0.0000005197 0.53855 9.11528
268 1R18 SAH 0.009561 0.42365 9.2511
269 5JGL SAM 0.00000007882 0.58861 9.32203
270 2AOT SAH 0.000001082 0.53452 9.32203
271 1JQD SAH 0.00001356 0.53262 9.32203
272 5BW4 SAM 0.00001213 0.50288 9.32203
273 1SQF SAM 0.0000163 0.50259 9.32203
274 4FZV SAM 0.00003004 0.50128 9.32203
275 1JQD HSM 0.00007641 0.49414 9.32203
276 4LWP SAH 0.0001882 0.4599 9.32203
277 1IM8 SAI 0.002167 0.45205 9.32203
278 1V8B NAD 0.008467 0.41582 9.32203
279 1JG3 ADN 0.000009965 0.51201 9.3617
280 3VC1 GST 0.000002154 0.58483 9.74576
281 3VC1 SAH 0.000002154 0.58483 9.74576
282 1N2X SAM 0.00009301 0.4547 9.74576
283 5IL1 SAM 0.003373 0.41574 9.74576
284 3AYI HCI 0.01862 0.41374 9.74576
285 3AYI FAD 0.01799 0.41374 9.74576
286 3P2E SAH 0.00004446 0.49404 9.77778
287 5JJR SAH 0.00008374 0.48509 10.1695
288 2JJQ SAH 0.00009431 0.45078 10.1695
289 5GT9 NAP 0.01068 0.40557 10.1695
290 5DM1 SAH 0.0000008207 0.60092 10.5932
291 5DM1 5D7 0.0000008891 0.60092 10.5932
292 3PFG SAM 0.000435 0.51171 10.5932
293 3PFG TLO 0.000435 0.51171 10.5932
294 1G60 SAM 0.00003008 0.49887 10.5932
295 2NXE SAM 0.0000388 0.48679 10.5932
296 3EGV SAH 0.0001509 0.47906 10.5932
297 1FP1 SAH 0.002302 0.44263 10.5932
298 2RGO FAD 0.003458 0.4346 10.5932
299 1D4D FAD 0.007674 0.42467 10.5932
300 2AE2 PTO 0.015 0.40843 10.5932
301 2AE2 NAP 0.015 0.40843 10.5932
302 2AG5 NAD 0.01116 0.40348 10.5932
303 3NUG NAD 0.01336 0.40121 10.5932
304 2JHP SAH 0.002107 0.42852 11.0169
305 3NJ4 AFX 0.04804 0.4177 11.0169
306 3NJ4 NAD 0.04804 0.4177 11.0169
307 4C3Y ANB 0.01592 0.41243 11.0169
308 4C3Y FAD 0.01287 0.41243 11.0169
309 4YDD MD1 0.04769 0.4034 11.0169
310 4YDD MGD 0.04769 0.4034 11.0169
311 3JWH SAH 0.00000001604 0.58303 11.0599
312 1WUW TSU 0.0189 0.40757 11.1111
313 4M37 SAH 0.01638 0.40934 11.4407
314 1F3L SAH 0.000009904 0.50262 11.8644
315 3WGT FAD 0.008707 0.42556 11.8644
316 3WGT QSC 0.009061 0.42556 11.8644
317 2F5Z FAD 0.02032 0.40497 11.8644
318 3DXY SAM 0.00001626 0.54152 11.9266
319 3OU2 SAH 0.000001479 0.50628 12.3853
320 2ZIF SAM 0.0000232 0.50364 12.7119
321 2BRY FAD 0.007648 0.41446 12.7119
322 4TXI FAD 0.01306 0.40284 12.7119
323 3FZG SAM 0.00000797 0.50036 13
324 5E72 SAM 0.000002476 0.54994 13.1356
325 4KRG SAH 0.0000008 0.54976 13.1356
326 1UWK URO 0.000488 0.48219 13.1356
327 1UWK NAD 0.000488 0.48219 13.1356
328 5KOK SAH 0.000006784 0.52622 13.5593
329 5KOK S9T 0.0000298 0.524 13.5593
330 5KOK R9T 0.0001282 0.49405 13.5593
331 1COY FAD 0.01388 0.41092 13.5593
332 1COY AND 0.03096 0.40516 13.5593
333 4YMH SAH 0.0001086 0.46793 13.9831
334 5JAQ NAI 0.01169 0.41247 13.9831
335 5FA8 SAM 0.00001272 0.52181 14.2857
336 3GDH SAH 0.000001669 0.511 14.4068
337 2O07 SPD 0.001527 0.4418 14.4068
338 2O07 MTA 0.00131 0.4418 14.4068
339 4KIB SAH 0.0000002368 0.56861 14.8305
340 5E1M SAH 0.000009874 0.54556 14.8305
341 5E1M PRO PRO LYS ARG ILE ALA 0.000009874 0.54556 14.8305
342 5THY SAH 0.00003228 0.49995 14.8305
343 5THZ SAH 0.00006733 0.49068 14.8305
344 4HSU FAD 0.009607 0.42102 14.8305
345 4NBU NAI 0.005018 0.4202 14.8305
346 4GUT FAD 0.01092 0.42012 14.8305
347 4FWE FAD 0.009628 0.42009 14.8305
348 4M73 SAH 0.0000004752 0.60836 15.2542
349 4M73 M72 0.0000008187 0.59934 15.2542
350 3G89 SAM 0.00000004309 0.57673 15.678
351 1LSS NAD 0.0001307 0.46422 15.7143
352 4J56 FAD 0.01334 0.41436 15.7895
353 1Q0S SAH 0.00006206 0.49424 15.8301
354 3EGI ADP 0.000001898 0.61273 16.0194
355 1NV8 MEQ 0.00003732 0.5096 16.1017
356 1NV8 SAM 0.00004101 0.5096 16.1017
357 2PZM UDP 0.002318 0.44878 16.1017
358 2PZM NAD 0.002318 0.44878 16.1017
359 1ZQ9 SAM 0.0009845 0.43066 16.1017
360 2GAG FAD 0.01335 0.41519 16.1616
361 3AD8 FAD 0.02607 0.41369 16.1616
362 3AD8 PYC 0.02607 0.41369 16.1616
363 2GAG FOA 0.02014 0.40681 16.1616
364 3AD8 NAD 0.01323 0.40486 16.1616
365 2GAG NAD 0.01616 0.40404 16.1616
366 5LOG SAH 0.001297 0.42974 16.309
367 4DCM SAM 0.0005107 0.43148 16.5254
368 1S7G NAD 0.009129 0.40861 16.5254
369 1S7G APR 0.01252 0.40482 16.5254
370 3LCC SAH 0.00000008464 0.58774 16.9492
371 3LST SAH 0.0009347 0.45799 16.9492
372 3SSO SAH 0.001627 0.45281 16.9492
373 5DNK SAH 0.000001484 0.50068 17.3729
374 4EMI FAD 0.01254 0.4101 17.7966
375 3H8V ATP 0.00281 0.41175 17.8082
376 4GQB 0XU 0.01664 0.44164 18.1818
377 3GU3 SAH 0.000000206 0.64081 18.2203
378 2FK8 SAM 0.000004904 0.53477 18.2203
379 4A6D SAM 0.00306 0.44319 18.6441
380 4M38 SAH 0.0001399 0.47286 19.0476
381 1TPY SAH 0.0000032 0.54518 19.0678
382 3S5W FAD 0.009466 0.40791 19.4915
383 4KRI SAH 0.000000007617 0.63603 19.9153
384 5FA5 MTA 0.00001323 0.4944 20
385 5GWX SAR 0.00001594 0.46506 20.339
386 5GWX SAM 0.00001594 0.46506 20.339
387 1Z3C SA8 0.000001386 0.57644 20.7627
388 1I1N SAH 0.000002791 0.55901 20.7965
389 1VE3 SAM 0.00000000539 0.66607 21.1454
390 4OBW SAM 0.0000001559 0.60298 21.7899
391 4YSX FAD 0.008771 0.41918 21.8085
392 1L1E SAH 0.000006714 0.51736 22.0339
393 3X0D SAH 0.0001824 0.46578 22.0339
394 4QTU SAM 0.00000005227 0.61557 22.1154
395 3H2B SAH 0.00000176 0.551 22.6601
396 1WY7 SAH 0.000574 0.44875 22.7053
397 3QOX SAH 0.000002244 0.55423 22.8814
398 5MW4 5JU 0.00002713 0.53437 22.8814
399 3T7S SAM 0.00000002693 0.61708 23.3051
400 3MQ2 SAH 0.000009863 0.53134 23.3945
401 3BXO SAM 0.000000002868 0.62349 23.7288
402 5F8F SFG 0.000005182 0.51218 24.1525
403 5DLY SAH 0.000005365 0.42418 24.1525
404 5DLY 5D7 0.000006232 0.4139 24.1525
405 4IWN GEK 0.0000000118 0.65227 24.4541
406 4PNE SAH 0.00000000831 0.65882 24.5763
407 1G8K MGD 0.02686 0.41418 24.5763
408 1KPG SAH 0.000004061 0.54075 25
409 5GM1 SAH 0.000000005515 0.61505 25.4237
410 4R6W SAH 0.0000007075 0.47525 25.5814
411 1KPH SAH 0.000003697 0.54249 25.8475
412 4X9M FAD 0.0136 0.4104 25.8475
413 4NEC SAH 0.000000202 0.56113 26.2712
414 2XVM SAH 0.0000008167 0.52891 26.6332
415 4AZT SAM 0.000000676 0.57547 27.5424
416 4AZW SAM 0.000003115 0.54051 27.5424
417 1L3I SAH 0.03161 0.40473 27.6042
418 1EJ0 SAM 0.000454 0.44436 30.5556
419 5JE0 SAH 0.0000003393 0.60556 32.2034
420 5JE0 AZ8 0.0000003393 0.60556 32.2034
Pocket No.: 2; Query (leader) PDB : 5MGZ; Ligand: SAH; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 5mgz.bio1) has 22 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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