Receptor
PDB id Resolution Class Description Source Keywords
1TPY 2.2 Å EC: 2.1.1.79 STRUCTURE OF THE CYCLOPROPANE SYNTHASE MMAA2 FROM MYCOBACTERIUM TUBERCULOSIS MYCOBACTERIUM TUBERCULOSIS METHYLTRANSFERASE CYCLOPROPANE SYNTHASE MYCOLIC ACIDS TUBERCULOSIS SAM-DEPENDENT
Ref.: STRUCTURE OF THE CYCLOPROPANE SYNTHASE MMAA2 FROM MYCOBACTERIUM TUBERCULOSIS TO BE PUBLISHED
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
16A A:1901;
Valid;
none;
submit data
284.543 C19 H42 N CCCCC...
CO3 A:902;
Invalid;
none;
submit data
60.009 C O3 C(=O)...
SAH A:1900;
Valid;
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
1TPY 2.2 Å EC: 2.1.1.79 STRUCTURE OF THE CYCLOPROPANE SYNTHASE MMAA2 FROM MYCOBACTERIUM TUBERCULOSIS MYCOBACTERIUM TUBERCULOSIS METHYLTRANSFERASE CYCLOPROPANE SYNTHASE MYCOLIC ACIDS TUBERCULOSIS SAM-DEPENDENT
Ref.: STRUCTURE OF THE CYCLOPROPANE SYNTHASE MMAA2 FROM MYCOBACTERIUM TUBERCULOSIS TO BE PUBLISHED
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 1TPY - SAH C14 H20 N6 O5 S c1nc(c2c(n....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1L1E - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 1TPY - SAH C14 H20 N6 O5 S c1nc(c2c(n....
3 1KPH - SAH C14 H20 N6 O5 S c1nc(c2c(n....
50% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 44 families.
1 1L1E - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 1TPY - SAH C14 H20 N6 O5 S c1nc(c2c(n....
3 1KPH - SAH C14 H20 N6 O5 S c1nc(c2c(n....
4 2FK8 - SAM C15 H22 N6 O5 S C[S@@+](CC....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 16A; Similar ligands found: 8
No: Ligand ECFP6 Tc MDL keys Tc
1 16A 1 1
2 10A 0.592593 1
3 DET 0.571429 0.756757
4 LDA 0.571429 0.756757
5 DDQ 0.571429 0.756757
6 D9G 0.457143 0.805556
7 XA7 0.428571 0.931035
8 ZWI 0.4 0.604167
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 : 1TPY; Ligand: 16A; Similar sites found: 15
This union binding pocket(no: 1) in the query (biounit: 1tpy.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5D3U TRP 0.01109 0.41471 1.39373
2 2W8Q SIN 0.007779 0.42323 2.09059
3 4ORM ORO 0.02137 0.42511 3.13589
4 4ORM FMN 0.02137 0.42511 3.13589
5 4ORM 2V6 0.02137 0.42511 3.13589
6 3QP8 HL0 0.006629 0.40426 3.80435
7 3K0T BGC 0.02523 0.40485 4.1958
8 4I9B 1KA 0.03022 0.40235 4.87805
9 4F9U PBD 0.01458 0.40871 5.22648
10 4G9N NGA 0.01726 0.4053 6.99301
11 2VPY PCI 0.0115 0.41392 8.69565
12 3VC1 SAH 0.01876 0.41307 14.9826
13 1KTG AMP 0.01147 0.40674 18.8406
14 5KOK S9T 0.0004603 0.48427 25.4355
15 4KRI 1SH 0.007507 0.4246 37.9791
Pocket No.: 2; Query (leader) PDB : 1TPY; Ligand: SAH; Similar sites found: 389
This union binding pocket(no: 2) in the query (biounit: 1tpy.bio1) has 24 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2FKA BEF 0.008047 0.43402 None
2 3FGZ BEF 0.01438 0.41491 None
3 3U31 NAD 0.002062 0.41794 0.696864
4 3G2O SAM 0.000009716 0.5304 1.39373
5 2AE2 NAP 0.01286 0.40582 1.53846
6 2AE2 PTO 0.01286 0.40582 1.53846
7 3CBG SAH 0.002112 0.43223 1.72414
8 1RJD SAM 0.0002417 0.46042 1.74216
9 2DPM SAM 0.0003925 0.44756 1.76056
10 5O4J SAH 0.00338 0.42492 1.82482
11 5O4J 9KH 0.00338 0.42492 1.82482
12 5O4J PJL 0.003523 0.42292 1.82482
13 3WV8 ATP 0.001533 0.41452 1.83486
14 2Q1S NAI 0.009121 0.41523 1.85676
15 1UWK NAD 0.003752 0.43434 2.09059
16 2UYQ SAM 0.009441 0.42606 2.09059
17 1RYI FAD 0.005215 0.42419 2.09059
18 4TXI FAD 0.003533 0.42162 2.09059
19 4RPL FAD 0.01374 0.42042 2.09059
20 4RPL 3UC 0.01589 0.41925 2.09059
21 1YKJ FAD 0.01459 0.41857 2.09059
22 1YKJ PHB 0.01459 0.41857 2.09059
23 4J36 1HR 0.008121 0.41749 2.09059
24 4J36 FAD 0.005412 0.41487 2.09059
25 1UP7 NAD 0.003383 0.41402 2.09059
26 4CNK FAD 0.01081 0.40722 2.09059
27 2YVF FAD 0.02974 0.40283 2.09059
28 2YVF NAD 0.03065 0.40283 2.09059
29 1VJT NAD 0.006917 0.40244 2.09059
30 2HK9 ATR 0.01352 0.41066 2.18182
31 4C4A SAH 0.00002736 0.50531 2.43902
32 3X0D SAH 0.0000332 0.50171 2.43902
33 2EFJ SAH 0.00002793 0.47371 2.43902
34 1ELI PYC 0.001743 0.44209 2.43902
35 1NVM NAD 0.002005 0.43349 2.43902
36 1SQF SAM 0.001729 0.43209 2.43902
37 5BUK FAD 0.00422 0.43113 2.43902
38 1MO9 FAD 0.0211 0.41878 2.43902
39 1MO9 KPC 0.02203 0.41837 2.43902
40 5U8U FAD 0.01762 0.41596 2.43902
41 4WCX ALA 0.009984 0.41584 2.43902
42 4USR FAD 0.005303 0.41525 2.43902
43 1TUU AMP 0.02002 0.40623 2.43902
44 2Q28 ADP 0.007388 0.40121 2.43902
45 1PR9 NAP 0.01018 0.40299 2.45902
46 3D3W NAP 0.01178 0.40024 2.45902
47 5XVQ SAH 0.0002107 0.4519 2.46479
48 1AX2 NDG GAL 0.004495 0.44409 2.51046
49 2AJH MET 0.009004 0.43474 2.55102
50 3FUU ADN 0.00001322 0.51882 2.58303
51 5D4V SAH 0.00301 0.41118 2.61194
52 2Y7I ARG 0.01508 0.40831 2.62009
53 3RKR NAP 0.00285 0.44386 2.67176
54 4J4H NAI 0.04728 0.42174 2.7027
55 4J4H 1J1 0.008506 0.4192 2.7027
56 5FJN BE2 0.001232 0.45605 2.78746
57 5FJN FAD 0.001055 0.45605 2.78746
58 4LWP SAH 0.0002317 0.44236 2.78746
59 2V3V MGD 0.006927 0.43863 2.78746
60 3CTY FAD 0.007837 0.41908 2.78746
61 4USQ FAD 0.004701 0.4187 2.78746
62 3ITJ FAD 0.01049 0.4175 2.78746
63 1B4N GUA 0.01619 0.41651 2.78746
64 3VSE SAH 0.0006971 0.40058 2.78746
65 3GU3 SAH 0.000041 0.53405 2.8169
66 5KVA SAM 0.0004199 0.44635 2.8777
67 1KYQ NAD 0.0006775 0.45427 2.91971
68 5N53 8NB 0.002666 0.45833 3.07692
69 4M73 SAH 0.0000284 0.51776 3.13589
70 4KIB SAH 0.00001089 0.48512 3.13589
71 4Y2H SAH 0.000211 0.4836 3.13589
72 4Y2H 49K 0.0002161 0.48314 3.13589
73 5HJM MTA 0.000595 0.44808 3.13589
74 5JGL SAM 0.0001346 0.4455 3.13589
75 1U2Z SAH 0.001745 0.4227 3.13589
76 5G3U FDA 0.005988 0.41853 3.13589
77 3TKA SAM 0.002441 0.4183 3.13589
78 1ZMD NAI 0.001006 0.41478 3.13589
79 4M73 M72 0.00003048 0.41274 3.13589
80 5XVK SAH 0.0001119 0.47203 3.16901
81 3MQ2 SAH 0.0002756 0.47171 3.21101
82 2VT3 ATP 0.000247 0.41795 3.25581
83 5IL1 SAM 0.009108 0.40049 3.30189
84 5CUQ NSC 0.0009663 0.44582 3.37079
85 1XDS SAM 0.0004361 0.47272 3.48432
86 5MW4 5JU 0.0005712 0.46569 3.48432
87 2P41 SAH 0.0003187 0.46418 3.48432
88 1QZZ SAM 0.0009015 0.458 3.48432
89 3QOX SAH 0.0003536 0.45136 3.48432
90 4II2 ATP 0.0005454 0.4456 3.48432
91 3I53 SAH 0.0005651 0.44496 3.48432
92 2ZWA SAH 0.0008629 0.43349 3.48432
93 3ZNN FAD 0.007386 0.42897 3.48432
94 3GGO ENO 0.004567 0.42772 3.48432
95 5JCM NAD 0.01018 0.42716 3.48432
96 5JCM ISD 0.01018 0.42716 3.48432
97 5JCM FAD 0.009866 0.42716 3.48432
98 4YNU FAD 0.005839 0.42481 3.48432
99 4YNU LGC 0.006958 0.42481 3.48432
100 1PN0 IPH 0.007464 0.42343 3.48432
101 1PN0 FAD 0.007158 0.42343 3.48432
102 2VHW NAI 0.004723 0.4209 3.48432
103 4X9M FAD 0.006548 0.41883 3.48432
104 4YRY FAD 0.009656 0.41322 3.48432
105 4YRY NAD 0.01458 0.41322 3.48432
106 4YAG NAI 0.01029 0.41198 3.48432
107 5A3B APR 0.004326 0.41105 3.48432
108 2PZM UDP 0.01281 0.40862 3.48432
109 2PZM NAD 0.01281 0.40862 3.48432
110 2WPB ZZI 0.02555 0.40497 3.48432
111 1WG8 SAM 0.00005015 0.48848 3.50877
112 1I1N SAH 0.0001805 0.47075 3.53982
113 3LCV SAM 0.00006984 0.48048 3.55872
114 1M2X MCO 0.0369 0.40054 3.58744
115 3EVG SAH 0.0002503 0.46876 3.63636
116 3A27 SAM 0.0007856 0.44706 3.67647
117 1X14 NAD 0.001099 0.4449 3.74065
118 2EG5 SAH 0.00006991 0.50982 3.83275
119 1V59 NAD 0.000126 0.50386 3.83275
120 1G55 SAH 0.0003838 0.45623 3.83275
121 4A6D SAM 0.0006888 0.44536 3.83275
122 3O7W SAM 0.0000619 0.44412 3.83275
123 1BZL FAD 0.01045 0.43967 3.83275
124 1DMR PGD 0.01376 0.42221 3.83275
125 5EB4 FAD 0.005754 0.42132 3.83275
126 1Q9I TEO 0.01139 0.42028 3.83275
127 4UP3 FAD 0.006415 0.41923 3.83275
128 3LAD FAD 0.008711 0.41522 3.83275
129 4MIG G3F 0.01651 0.40775 3.83275
130 4RVG SAM 0.00001698 0.407 3.83275
131 1J0X NAD 0.01705 0.40304 3.83275
132 1GVF PGH 0.02619 0.40441 3.84615
133 3FRH SAH 0.00002413 0.49956 3.95257
134 3HVJ 705 0.0004142 0.46827 4.0724
135 5DM1 5D7 0.00002693 0.52297 4.11985
136 5DM1 SAH 0.00002518 0.52289 4.11985
137 3DXY SAM 0.000007017 0.56377 4.12844
138 1UAY ADN 0.001667 0.44553 4.13223
139 5MPT SAH 0.00005411 0.49782 4.18118
140 2JJQ SAH 0.0003143 0.47935 4.18118
141 4BLW AMP 0.0002449 0.47427 4.18118
142 3GRU AMP 0.0001929 0.46224 4.18118
143 4BLW SAH 0.0003142 0.45891 4.18118
144 5F2K SAH 0.0008209 0.44886 4.18118
145 5F2K OCA 0.0008209 0.44886 4.18118
146 3NTD FAD 0.007927 0.41316 4.18118
147 5MBX FAD 0.01826 0.40942 4.18118
148 5MBX SP5 0.01826 0.40942 4.18118
149 3NT6 FAD 0.01286 0.40389 4.18118
150 3F8D FAD 0.04161 0.40101 4.18118
151 3BGD SAH 0.000004113 0.52073 4.23077
152 3BGD PM6 0.0000163 0.47034 4.23077
153 4RL4 PPV 0.00235 0.47022 4.24528
154 3A25 SAM 0.0004668 0.45694 4.31894
155 4IF4 BEF 0.01393 0.41517 4.32692
156 3P2E SAH 0.00003756 0.49432 4.44444
157 2VDV SAM 0.0000187 0.53655 4.47154
158 4YDD MD1 0.003522 0.45252 4.52962
159 4YDD MGD 0.003522 0.45252 4.52962
160 1NW5 SAM 0.001209 0.43491 4.52962
161 4DMG SAM 0.003959 0.43229 4.52962
162 1X87 NAD 0.001563 0.41778 4.52962
163 1RP0 AHZ 0.003213 0.4234 4.57746
164 2PXX SAH 0.000000568 0.5773 4.65116
165 3LCC SAH 0.000002131 0.56595 4.68085
166 2F5Z FAD 0.01867 0.40127 4.6875
167 1XTP SAI 0.000003654 0.54895 4.72441
168 2GN3 MAN 0.01399 0.41985 4.7619
169 2GNB MAN 0.01491 0.41676 4.7619
170 2GNM MAN 0.02068 0.41274 4.7619
171 2GMM MAN MAN 0.02836 0.40333 4.7619
172 2GN3 MMA 0.01695 0.40258 4.7619
173 2GND MAN 0.03457 0.40007 4.7619
174 5E72 SAM 0.00001431 0.50667 4.87805
175 1ZGA SAH 0.001896 0.44292 4.87805
176 3H8V ATP 0.001564 0.43399 4.87805
177 3UOY FAD 0.01298 0.4234 4.87805
178 3UOY NAP 0.01298 0.4234 4.87805
179 2JHP SAH 0.004429 0.41785 4.87805
180 3EF0 ALF 0.02226 0.41045 4.87805
181 2V3A FAD 0.01035 0.40804 4.87805
182 3C6K MTA 0.0109 0.40501 4.87805
183 3C6K SPD 0.0109 0.40501 4.87805
184 5UAO FAD 0.01323 0.40335 4.87805
185 1R37 NAD 0.006468 0.41269 4.89914
186 1P1C SAH 0.0007091 0.43207 5.02513
187 3OU2 SAH 0.000114 0.44917 5.04587
188 5LOG SAH 0.00152 0.4159 5.15021
189 1L3I SAH 0.00002355 0.46833 5.20833
190 3ICT ADP 0.0006924 0.4685 5.22648
191 3ICS ADP 0.0009557 0.46181 5.22648
192 3LST SAH 0.000769 0.46122 5.22648
193 4RSL FAD 0.0006437 0.45867 5.22648
194 5JJR SAH 0.0009543 0.44337 5.22648
195 1Y8Q ATP 0.000267 0.44329 5.22648
196 4BV6 FAD 0.003575 0.43148 5.22648
197 4YSX FAD 0.00989 0.41089 5.22648
198 3SSO SAH 0.004087 0.4089 5.22648
199 3ICR FAD 0.01093 0.40599 5.22648
200 5X62 SAH 0.00001476 0.52844 5.57491
201 4M37 SAH 0.00005367 0.49279 5.57491
202 4M38 SAH 0.00004532 0.4909 5.57491
203 3ML1 MGD 0.00167 0.46719 5.57491
204 3LKZ SFG 0.0005981 0.44799 5.57491
205 1I0B PEL 0.002996 0.42781 5.57491
206 4D7E FAD 0.004232 0.42298 5.57491
207 2YX1 SFG 0.000363 0.41764 5.57491
208 3CGD FAD 0.03576 0.40722 5.57491
209 3CGD COA 0.03576 0.40722 5.57491
210 2FJK 13P 0.02028 0.40196 5.57491
211 2PX8 SAH 0.008186 0.40253 5.57621
212 3ZJQ NCA 0.01868 0.42348 5.64103
213 3GCZ SAM 0.0005032 0.43052 5.67376
214 2DT5 NAD 0.0008327 0.40174 5.6872
215 5TP0 BRN 0.02633 0.40528 5.80357
216 2Q89 6CS 0.009314 0.42303 5.83658
217 3Q87 SAM 0.0005281 0.43534 5.88235
218 4DCM SAM 0.000599 0.46135 5.92335
219 3LXD FAD 0.002432 0.43232 5.92335
220 2BRY FAD 0.002615 0.42851 5.92335
221 2GCG DGY 0.02943 0.41121 5.92335
222 2WCI GSH 0.02449 0.404 5.92593
223 2PWY SAH 0.0001098 0.47236 6.20155
224 5L95 AMP 0.001292 0.41981 6.25
225 4ONQ SFG 0.000007387 0.5356 6.27178
226 1G8K MGD 0.004888 0.44397 6.27178
227 5EZ7 FAD 0.008547 0.41272 6.27178
228 1MUU NAD 0.001075 0.40772 6.27178
229 1MV8 NAD 0.001301 0.40452 6.27178
230 3OJO NAD 0.003831 0.40144 6.27178
231 5BW4 SAM 0.000005852 0.49476 6.36704
232 4XUC 43G 0.001242 0.44375 6.42202
233 4XUC SAM 0.001242 0.44375 6.42202
234 2ZFU SAH 0.000027 0.48904 6.51163
235 3TKY SAH 0.0006437 0.42988 6.62021
236 3UCL NAP 0.01013 0.42907 6.62021
237 3UCL CYH 0.009264 0.42907 6.62021
238 3UCL FAD 0.009264 0.42907 6.62021
239 1E1M FAD 0.02405 0.40319 6.62021
240 2ZIF SAM 0.00006941 0.48801 6.96864
241 3NJ4 NAD 0.02115 0.43092 6.96864
242 2DKH 3HB 0.01108 0.40773 6.96864
243 2DKH FAD 0.007996 0.40754 6.96864
244 5JCA FAD 0.01847 0.40061 6.96864
245 3FZG SAM 0.000009914 0.54261 7
246 4POO SAM 0.0001116 0.4561 7
247 1L5Y BEF 0.007548 0.42614 7.09677
248 3PFG SAM 0.03212 0.41319 7.22433
249 1G60 SAM 0.00004179 0.49743 7.30769
250 4KRG SAH 0.00003582 0.51126 7.31707
251 5DNK SAH 0.00001855 0.44987 7.31707
252 3VYW SAM 0.001359 0.42898 7.31707
253 9LDT NAD 0.006126 0.41009 7.31707
254 3B6R CRN 0.01235 0.40598 7.31707
255 4CVN ADP 0.03092 0.40064 7.32984
256 3OFK SAH 0.0002166 0.45817 7.40741
257 3MB5 SAM 0.0001016 0.46465 7.45098
258 2HMT NAI 0.002762 0.41271 7.63889
259 3A4T SFG 0.0004218 0.44627 7.66423
260 3H2B SAH 0.000001993 0.55398 7.66551
261 1N2X SAM 0.00004449 0.4788 7.66551
262 3PT9 SAH 0.0002536 0.44008 7.66551
263 1V6A TRE 0.007952 0.43286 7.66551
264 4TM3 FAD 0.01476 0.42135 7.66551
265 1P77 ATR 0.007707 0.43199 7.72059
266 2BZG SAH 0.000001393 0.56725 7.75862
267 1I9G SAM 0.0002258 0.46167 7.85714
268 1MFI FHC 0.01954 0.41387 7.89474
269 5DLY SAH 0.00006093 0.40546 7.89474
270 3TLJ SAH 0.0001412 0.45879 8.01394
271 2Q3M MLA 0.02674 0.41712 8.01394
272 1ZQ9 SAM 0.00008297 0.48971 8.07018
273 3GDH SAH 0.00001189 0.49286 8.29876
274 1SQS TLA 0.02147 0.40523 8.67769
275 3S1S SAH 0.0008882 0.42672 8.7108
276 4X7Y SAH 0.01463 0.40424 8.75912
277 3BXO SAM 0.00001554 0.5403 8.78661
278 1QAN SAH 0.00008447 0.47498 9.01639
279 5E9W SAH 0.000003848 0.47489 9.05923
280 3CM2 X23 0.03438 0.40128 9.23077
281 4AZT SAM 0.000001572 0.56496 9.40767
282 4AZW SAM 0.000007952 0.52826 9.40767
283 2IZ1 ATR 0.001346 0.47335 9.40767
284 3DMH SAM 0.0001907 0.46474 9.40767
285 3DMH GMP 0.0003826 0.41665 9.40767
286 2WA2 SAM 0.001017 0.41305 9.42029
287 4D42 W0I 0.02383 0.40122 9.57447
288 4D42 NAP 0.02383 0.40122 9.57447
289 3EGI ADP 0.00003082 0.55564 9.70874
290 1LVL NAD 0.0008201 0.43818 9.7561
291 4OPC FDA 0.01439 0.43332 9.7561
292 3OND ADN 0.01036 0.41616 9.7561
293 1LSS NAD 0.0008273 0.43802 10
294 1EJ0 SAM 0.001995 0.42936 10
295 4RDH AMP 0.0002288 0.48042 10.453
296 2R4J 13P 0.002532 0.44723 10.453
297 4RDI ATP 0.0003813 0.43527 10.453
298 2CDU ADP 0.002473 0.42917 10.453
299 4REP FAD 0.006515 0.41793 10.453
300 1OBB NAD 0.001767 0.40907 10.453
301 4IWN GEK 0.00002385 0.49977 10.4803
302 5FA8 SAM 0.0001064 0.47292 10.559
303 2AOT SAH 0.0000002519 0.53662 10.8014
304 4PIO SAH 0.0007344 0.45363 10.8014
305 4PIO AVI 0.0007699 0.45142 10.8014
306 4D79 ATP 0.0002367 0.44344 10.8696
307 1NV8 MEQ 0.000006828 0.53075 10.9155
308 1NV8 SAM 0.000007978 0.52983 10.9155
309 3GXO SAH 0.003477 0.42647 11.1111
310 3GWZ SAH 0.001497 0.40217 11.1111
311 1Q0S SAH 0.0002234 0.44461 11.1969
312 3AD8 PYC 0.006493 0.43693 11.33
313 3AD8 FAD 0.006493 0.43693 11.33
314 3AD8 NAD 0.00488 0.418 11.33
315 2NXE SAM 0.000008659 0.53259 11.4173
316 3EGV SAH 0.00001712 0.52556 11.4173
317 1Z3C SA8 0.00004624 0.4367 11.4983
318 3IWD M2T 0.01607 0.41546 11.7647
319 1F3L SAH 0.00001925 0.50138 11.8467
320 1JQD SAH 0.00000595 0.46657 11.8467
321 1JQD HSM 0.00009227 0.44551 11.8467
322 5J60 FAD 0.005011 0.42398 11.8467
323 3O8M GLC 0.02208 0.40013 11.8467
324 3O8M BGC 0.02208 0.40013 11.8467
325 2HNK SAH 0.002018 0.42177 12.1339
326 5M58 SAH 0.00001147 0.49988 12.6087
327 4OBW SAM 0.0001079 0.48472 12.8405
328 2YVJ NAI 0.004769 0.41281 12.844
329 5FTW SAH 0.001487 0.42733 12.8906
330 4QTU SAM 0.0000003239 0.58773 12.9808
331 3DUW SAH 0.0005443 0.44974 13.0045
332 2BOS GLA GAL GLC NBU 0.03794 0.40038 13.2353
333 4PNE SAH 0.0000000005717 0.69075 13.5889
334 4EIP K2C 0.008935 0.41824 13.5889
335 4EIP FAD 0.008935 0.41824 13.5889
336 2A14 SAH 0.000139 0.46608 13.6882
337 3JWH SAH 0.00002073 0.45472 13.8249
338 4GQB 0XU 0.0003734 0.43649 13.9373
339 5FA5 MTA 0.0004316 0.42433 13.9373
340 5ULP KB1 0.0005906 0.42845 14.1791
341 5M67 NAD 0.01163 0.41467 14.2857
342 5M67 ADE 0.01197 0.41411 14.2857
343 5M67 3D1 0.0155 0.409 14.2857
344 3T7S SAM 0.00000007806 0.57488 14.9254
345 3VC1 SAH 0.00000001092 0.67417 14.9826
346 5DX0 SFG 0.00001315 0.51476 14.9826
347 5DWQ SFG 0.00001474 0.51059 14.9826
348 3VC1 GST 0.00000001092 0.49161 14.9826
349 2EJU SAH 0.0002168 0.47149 15.331
350 1FP1 SAH 0.001465 0.44362 15.6794
351 5DX1 SFG 0.00006561 0.48559 15.7895
352 5DX8 SFG 0.00006926 0.47113 15.7895
353 5DXA SFG 0.00007248 0.47053 15.7895
354 1R18 SAH 0.0002888 0.45304 15.859
355 5N5D SAM 0.0007723 0.42632 15.9292
356 5T67 JHZ 0.00002303 0.53357 16.3763
357 5T67 SAH 0.0000193 0.5307 16.3763
358 1WY7 SAH 0.004725 0.40311 16.4251
359 1JG3 ADN 0.00005771 0.4966 16.5957
360 5E1M SAH 0.000007539 0.53969 17.0124
361 5E1M PRO PRO LYS ARG ILE ALA 0.000007539 0.53969 17.0124
362 5GWX SAM 0.0007924 0.41441 17.6056
363 5GWX SAR 0.0007924 0.41441 17.6056
364 3G89 SAM 0.000000219 0.62667 17.6707
365 4FZV SAM 0.0008037 0.4305 17.77
366 5E8J SAH 0.000005941 0.55978 18.1818
367 4Q3F TLA 0.007326 0.43357 18.8034
368 5F8F SFG 0.00006071 0.5067 18.8153
369 5MGZ SAH 0.0000032 0.54518 19.0678
370 1DL5 SAH 0.0004189 0.45366 19.1638
371 4YMH SAH 0.0005812 0.44445 19.1667
372 2XVM SAH 0.00001383 0.46745 19.598
373 1IM8 SAI 0.000005923 0.52795 20.4918
374 1KYZ SAH 0.004044 0.41594 20.5575
375 4NEC SAH 0.0000008095 0.59224 21.5909
376 3NDJ JHZ 0.00002001 0.53748 21.9512
377 5JE0 AZ8 0.000006432 0.53751 22.6721
378 5JE0 SAH 0.000006432 0.53751 22.6721
379 1SQL GUN 0.01812 0.41256 23.9726
380 5KOK SAH 0.00000001201 0.61534 25.4355
381 5KOK S9T 0.0000003257 0.59873 25.4355
382 5KOK R9T 0.0000006583 0.58367 25.4355
383 1VE3 SAM 0.00001572 0.52127 28.1938
384 5THY SAH 0.00004428 0.49133 28.9199
385 5THZ SAH 0.00007079 0.48024 29.2683
386 4R6W SAH 0.00000004967 0.52217 29.4574
387 4R6W PC 0.0000002468 0.4117 29.4574
388 5GM1 SAH 0.0000000002482 0.68728 30.3136
389 4KRI SAH 0.000000006643 0.65163 37.9791
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