Receptor
PDB id Resolution Class Description Source Keywords
3EVG 2.2 Å EC: 2.7.7.48 CRYSTAL STRUCTURE OF DENGUE-2 VIRUS METHYLTRANSFERASE COMPLEXED WITH S-ADENOSYL-L-HOMOCYSTEINE DENGUE VIRUS 2 16681-PDK53 DENGUE VIRUS FLAVIVIRUS NS5 METHYLTRANSFERASE RNA CAP BINDING ATP-BINDING CAPSID PROTEIN CLEAVAGE ON PAIR OF BASIC RESIDUES ENDOPLASMIC RETICULUM ENVELOPE PROTEIN GLYCOPROTEIN HELICASE HYDROLASE MEMBRANE METAL-BINDINGMULTIFUNCTIONAL ENZYME NUCLEOTIDE-BINDING NUCLEOTIDYLTRANSFERASE NUCLEUS PHOSPHOPROTEIN PROTEASE RIBONUCLEOPROTEIN RNA REPLICATION RNA-BINDING RNA- DIRECTED RNA POLYMERASE SECRETED SERINE PROTEASE TRANSCRIPTION TRANSCRIPTION REGULATION TRANSMEMBRANE VIRAL NUCLEOPROTEIN VIRION
Ref.: ANALYSIS OF FLAVIVIRUS NS5 METHYLTRANSFERASE CAP BINDING. J.MOL.BIOL. V. 385 1643 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
SAH A:901;
Valid;
none;
submit data
384.411 C14 H20 N6 O5 S c1nc(...
SO4 A:902;
A:903;
A:904;
A:905;
A:906;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3EVG 2.2 Å EC: 2.7.7.48 CRYSTAL STRUCTURE OF DENGUE-2 VIRUS METHYLTRANSFERASE COMPLEXED WITH S-ADENOSYL-L-HOMOCYSTEINE DENGUE VIRUS 2 16681-PDK53 DENGUE VIRUS FLAVIVIRUS NS5 METHYLTRANSFERASE RNA CAP BINDING ATP-BINDING CAPSID PROTEIN CLEAVAGE ON PAIR OF BASIC RESIDUES ENDOPLASMIC RETICULUM ENVELOPE PROTEIN GLYCOPROTEIN HELICASE HYDROLASE MEMBRANE METAL-BINDINGMULTIFUNCTIONAL ENZYME NUCLEOTIDE-BINDING NUCLEOTIDYLTRANSFERASE NUCLEUS PHOSPHOPROTEIN PROTEASE RIBONUCLEOPROTEIN RNA REPLICATION RNA-BINDING RNA- DIRECTED RNA POLYMERASE SECRETED SERINE PROTEASE TRANSCRIPTION TRANSCRIPTION REGULATION TRANSMEMBRANE VIRAL NUCLEOPROTEIN VIRION
Ref.: ANALYSIS OF FLAVIVIRUS NS5 METHYLTRANSFERASE CAP BINDING. J.MOL.BIOL. V. 385 1643 2009
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 11 families.
1 3EVG - SAH C14 H20 N6 O5 S c1nc(c2c(n....
70% Homology Family (24)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 211 families.
1 2P3L - G3A C20 H27 N10 O17 P3 c1nc(c2c(n....
2 2P41 - G1G C22 H32 N10 O18 P3 Cn1c[n+](c....
3 1L9K - SAH C14 H20 N6 O5 S c1nc(c2c(n....
4 5M5B - SAM C15 H22 N6 O5 S C[S@@+](CC....
5 5GOZ - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
6 5GP1 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
7 5KQR - SAM C15 H22 N6 O5 S C[S@@+](CC....
8 5ULP Kd = 24.3 uM KB1 C21 H26 F N7 O5 c1cc(ccc1C....
9 5WXB - SAH C14 H20 N6 O5 S c1nc(c2c(n....
10 5KQS - SAM C15 H22 N6 O5 S C[S@@+](CC....
11 3EVG - SAH C14 H20 N6 O5 S c1nc(c2c(n....
12 2PX8 - MGT C11 H20 N5 O14 P3 CN1CN(C2=C....
13 2PX2 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
14 2PX4 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
15 5EKX - 2CQ C7 H9 Cl N2 Cc1cc(c(cc....
16 4R8S - SFG C15 H23 N7 O5 c1nc(c2c(n....
17 4CTJ - 3A9 C9 H8 O3 c1cc2c(cc1....
18 4CTK - SAM C15 H22 N6 O5 S C[S@@+](CC....
19 5EIW - X0V C7 H7 F3 N2 c1cc(c(cc1....
20 3P8Z - SAH C14 H20 N6 O5 S c1nc(c2c(n....
21 5CUQ ic50 = 7.7 uM NSC C21 H20 N6 O Cc1cc(c2cc....
22 5EIF - 4M0 C8 H9 N O2 Cc1ccc(c(c....
23 5EHI - 5O3 C20 H17 Cl N4 O5 S c1cc(cc(c1....
24 3P97 - SAM C15 H22 N6 O5 S C[S@@+](CC....
50% Homology Family (45)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3EVA - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 3EVC - SAH C14 H20 N6 O5 S c1nc(c2c(n....
3 3EVF - SAH C14 H20 N6 O5 S c1nc(c2c(n....
4 3EVB - SAH C14 H20 N6 O5 S c1nc(c2c(n....
5 3EVD - SAH C14 H20 N6 O5 S c1nc(c2c(n....
6 3EVE - SAH C14 H20 N6 O5 S c1nc(c2c(n....
7 3ELU - SAM C15 H22 N6 O5 S C[S@@+](CC....
8 3ELW - SAM C15 H22 N6 O5 S C[S@@+](CC....
9 3EMD - SFG C15 H23 N7 O5 c1nc(c2c(n....
10 3ELD - SFG C15 H23 N7 O5 c1nc(c2c(n....
11 3ELY - SAH C14 H20 N6 O5 S c1nc(c2c(n....
12 3EMB - SAM C15 H22 N6 O5 S C[S@@+](CC....
13 2P3L - G3A C20 H27 N10 O17 P3 c1nc(c2c(n....
14 2P41 - G1G C22 H32 N10 O18 P3 Cn1c[n+](c....
15 1L9K - SAH C14 H20 N6 O5 S c1nc(c2c(n....
16 5M5B - SAM C15 H22 N6 O5 S C[S@@+](CC....
17 5GOZ - GTP C10 H16 N5 O14 P3 c1nc2c(n1[....
18 5GP1 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
19 5KQR - SAM C15 H22 N6 O5 S C[S@@+](CC....
20 5ULP Kd = 24.3 uM KB1 C21 H26 F N7 O5 c1cc(ccc1C....
21 5MRK - SFG C15 H23 N7 O5 c1nc(c2c(n....
22 5WXB - SAH C14 H20 N6 O5 S c1nc(c2c(n....
23 5KQS - SAM C15 H22 N6 O5 S C[S@@+](CC....
24 3LKZ - SFG C15 H23 N7 O5 c1nc(c2c(n....
25 3EVG - SAH C14 H20 N6 O5 S c1nc(c2c(n....
26 2PX5 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
27 2PXA - SAH C14 H20 N6 O5 S c1nc(c2c(n....
28 2PX8 - MGT C11 H20 N5 O14 P3 CN1CN(C2=C....
29 2PX2 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
30 2PX4 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
31 5E9Q - SAM C15 H22 N6 O5 S C[S@@+](CC....
32 5EHG - 5O0 C20 H16 Cl N3 O6 S c1cc(cc(c1....
33 5EKX - 2CQ C7 H9 Cl N2 Cc1cc(c(cc....
34 4R8S - SFG C15 H23 N7 O5 c1nc(c2c(n....
35 4CTJ - 3A9 C9 H8 O3 c1cc2c(cc1....
36 4CTK - SAM C15 H22 N6 O5 S C[S@@+](CC....
37 5EC8 - 5LP C15 H14 Cl N3 O3 Cc1ccc(c(c....
38 5EIW - X0V C7 H7 F3 N2 c1cc(c(cc1....
39 3P8Z - SAH C14 H20 N6 O5 S c1nc(c2c(n....
40 5CUQ ic50 = 7.7 uM NSC C21 H20 N6 O Cc1cc(c2cc....
41 5EIF - 4M0 C8 H9 N O2 Cc1ccc(c(c....
42 5EHI - 5O3 C20 H17 Cl N4 O5 S c1cc(cc(c1....
43 3P97 - SAM C15 H22 N6 O5 S C[S@@+](CC....
44 3GCZ - SAM C15 H22 N6 O5 S C[S@@+](CC....
45 2WA2 - SAM C15 H22 N6 O5 S C[S@@+](CC....
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 : 3EVG; Ligand: SAH; Similar sites found: 479
This union binding pocket(no: 1) in the query (biounit: 3evg.bio1) has 21 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1PNO NAP 0.01418 0.40185 None
2 4EUE NAI 0.0001264 0.49769 0.956938
3 2W58 ADP 0.00842 0.41942 0.990099
4 3QVP FAD 0.009149 0.4243 1.45455
5 2O07 MTA 0.0004226 0.40263 1.45455
6 1JT2 FER 0.02216 0.40892 1.49254
7 1XTP SAI 0.00001919 0.51017 1.5748
8 1WG8 SAM 0.000001433 0.57162 1.81818
9 5HJM MTA 0.000004439 0.52647 1.81818
10 1SQF SAM 0.00001088 0.52075 1.81818
11 3O03 NAP 0.001779 0.43826 1.81818
12 2PK3 A2R 0.00128 0.43394 1.81818
13 2R4J 13P 0.01034 0.42832 1.81818
14 4BV6 FAD 0.007104 0.42764 1.81818
15 1H82 FAD 0.01263 0.42628 1.81818
16 1H82 GZZ 0.01477 0.42628 1.81818
17 5T67 JHZ 0.01885 0.41107 1.81818
18 5T67 SAH 0.01673 0.40918 1.81818
19 1E7S NAP 0.01233 0.40702 1.81818
20 1X87 NAD 0.008643 0.40311 1.81818
21 1ZEM NAD 0.002813 0.42937 1.9084
22 1JJ7 ADP 0.01382 0.42617 1.92308
23 1RSG FAD 0.001368 0.46229 1.93798
24 1YY5 FAD 0.003017 0.44804 1.94932
25 1QAN SAH 0.000006074 0.50391 2.04918
26 3D3W NAP 0.003874 0.43124 2.04918
27 1PR9 NAP 0.00489 0.42661 2.04918
28 5E72 SAM 0.000004233 0.54616 2.18182
29 4ONQ SFG 0.000004964 0.53537 2.18182
30 3L9W AMP 0.0002097 0.48618 2.18182
31 3U4C NDP 0.0004793 0.46688 2.18182
32 2AWN ADP 0.006225 0.45252 2.18182
33 3L9W GSH 0.001078 0.45104 2.18182
34 5F8F SFG 0.0003552 0.44481 2.18182
35 2Q1S NAI 0.004991 0.43676 2.18182
36 2C7G ODP 0.01369 0.42387 2.18182
37 2C7G FAD 0.01415 0.42387 2.18182
38 1I2B NAD 0.01815 0.4179 2.18182
39 4X9M FAD 0.01187 0.4162 2.18182
40 4GLL NAD 0.01341 0.40536 2.18182
41 2NVK FAD 0.02309 0.40347 2.18182
42 2YVF NAD 0.04724 0.40121 2.18182
43 2YVF FAD 0.04597 0.40121 2.18182
44 1I1N SAH 0.000002313 0.56901 2.21239
45 2A14 SAH 0.002084 0.42854 2.28137
46 1NFQ NAI 0.002483 0.43881 2.30769
47 2ZFU SAH 0.00002164 0.51288 2.32558
48 3OID NDP 0.00963 0.41312 2.32558
49 4NBW NAD 0.001415 0.44424 2.33463
50 1ZK4 NAP 0.005704 0.42698 2.39044
51 5T2U NAP 0.008775 0.41497 2.41935
52 4II2 ATP 0.001942 0.41208 2.45399
53 1P1C SAH 0.001497 0.40883 2.51256
54 4UCI SAM 0.000001116 0.56607 2.54545
55 4C4A SAH 0.000004668 0.53923 2.54545
56 3TLJ SAH 0.00000103 0.52148 2.54545
57 2ZIF SAM 0.00001222 0.52118 2.54545
58 2EJU SAH 0.000039 0.49695 2.54545
59 3X0D SAH 0.00004492 0.49676 2.54545
60 1FP1 SAH 0.00004583 0.48067 2.54545
61 4RPL 3UC 0.001911 0.47338 2.54545
62 3GXO SAH 0.0003159 0.46763 2.54545
63 4RPL FAD 0.002556 0.46511 2.54545
64 5JAQ NAI 0.001028 0.46488 2.54545
65 3GWZ SAH 0.0001232 0.45702 2.54545
66 3O7W SAM 0.0001375 0.4546 2.54545
67 4PIO AVI 0.001628 0.44847 2.54545
68 4PIO SAH 0.001735 0.44847 2.54545
69 1EK6 NAI 0.005434 0.4426 2.54545
70 2BGM NAJ 0.002522 0.43149 2.54545
71 4FWE FAD 0.006742 0.43058 2.54545
72 5MBX SP5 0.01371 0.42384 2.54545
73 5MBX FAD 0.01371 0.42384 2.54545
74 1ELI PYC 0.007701 0.42304 2.54545
75 3GRU AMP 0.004468 0.41573 2.54545
76 3T31 FAD 0.02129 0.41451 2.54545
77 3T31 DCQ 0.02269 0.41451 2.54545
78 1G0N PHH 0.01774 0.40889 2.54545
79 1G0N NDP 0.016 0.4082 2.54545
80 2CDU FAD 0.01553 0.4068 2.54545
81 3A27 SAM 0.00002316 0.50666 2.57353
82 3OIG NAD 0.005401 0.41815 2.63158
83 1O97 AMP 0.002337 0.4619 2.65152
84 1O97 FAD 0.002337 0.4619 2.65152
85 2DTX BMA 0.001961 0.4518 2.65152
86 3P2E SAH 0.001249 0.42039 2.66667
87 1GET FAD 0.02387 0.41837 2.66667
88 1GET NAP 0.02515 0.41837 2.66667
89 3TN7 NJP 0.004938 0.42393 2.72374
90 5L95 AMP 0.003119 0.41722 2.86738
91 3GDH SAH 0.00000001203 0.57904 2.90456
92 5KVA SAM 0.00003602 0.50554 2.90909
93 1QZZ SAM 0.00007326 0.502 2.90909
94 3TKY SAH 0.00004499 0.49674 2.90909
95 5GM1 SAH 0.00002524 0.47218 2.90909
96 4HXY NDP 0.000505 0.46887 2.90909
97 3I53 SAH 0.0001634 0.4547 2.90909
98 1RJD SAM 0.0005181 0.45298 2.90909
99 4TQG NDP 0.001165 0.44953 2.90909
100 2AOT SAH 0.0003504 0.44456 2.90909
101 3H4V DVP 0.004035 0.44017 2.90909
102 3H4V NAP 0.005562 0.43264 2.90909
103 2V6G NAP 0.003447 0.43102 2.90909
104 3LAD FAD 0.00917 0.42335 2.90909
105 5U8U FAD 0.02354 0.41809 2.90909
106 2WHX ADP 0.01463 0.41656 2.90909
107 1V59 NAD 0.001164 0.41629 2.90909
108 3SSO SAH 0.001813 0.41387 2.90909
109 5BUK FAD 0.01706 0.41231 2.90909
110 4U7W NDP 0.008697 0.40886 2.90909
111 5UAO FAD 0.01714 0.40679 2.90909
112 2RAB NAD 0.04242 0.40585 2.90909
113 2RAB FAD 0.02329 0.40585 2.90909
114 3IHG FAD 0.01384 0.40108 2.90909
115 2HNK SAH 0.0002054 0.47043 2.92887
116 1AE1 NAP 0.004652 0.4276 2.9304
117 3FUU ADN 0.001497 0.42319 2.95203
118 4YUW 4JU 0.00318 0.4775 2.96053
119 4YUW S4M 0.003116 0.4775 2.96053
120 5MGZ SAH 0.00009989 0.48178 2.9661
121 5BW4 SAM 0.0001432 0.4666 2.99625
122 5M58 SAH 0.0004321 0.45431 3.04348
123 3ICR FAD 0.004422 0.4332 3.06122
124 3ICT FAD 0.004855 0.43132 3.06122
125 3ICS FAD 0.005544 0.42969 3.06122
126 4OBW SAM 0.0007384 0.44213 3.11284
127 3OJF NDP 0.007118 0.42143 3.11284
128 3OJF IMJ 0.01471 0.41274 3.11284
129 5BQ5 ADP BEF 0.005336 0.41647 3.1746
130 3G89 SAM 0.0000314 0.51888 3.21285
131 3GU3 SAH 0.000005419 0.56931 3.27273
132 5MPT SAH 0.00001032 0.52172 3.27273
133 3VSE SAH 0.000009779 0.48981 3.27273
134 4A6D SAM 0.0001202 0.46734 3.27273
135 5DNK SAH 0.00004023 0.45795 3.27273
136 3A25 SAM 0.0003218 0.45761 3.27273
137 5JCM NAD 0.005126 0.45088 3.27273
138 5JCM FAD 0.004972 0.45088 3.27273
139 5JCM ISD 0.005126 0.45088 3.27273
140 3BGD SAH 0.00009418 0.44848 3.27273
141 5F2K SAH 0.002465 0.43895 3.27273
142 5F2K OCA 0.002465 0.43895 3.27273
143 3UCL CYH 0.01041 0.43569 3.27273
144 3UCL FAD 0.01041 0.43569 3.27273
145 3UCL NAP 0.01132 0.43569 3.27273
146 3MJE NDP 0.003141 0.43152 3.27273
147 5FJN FAD 0.007677 0.42699 3.27273
148 5FJN BE2 0.008743 0.42699 3.27273
149 4RSL FAD 0.006665 0.42385 3.27273
150 3BGD PM6 0.0001389 0.41772 3.27273
151 4EIP FAD 0.01587 0.41545 3.27273
152 4EIP K2C 0.01587 0.41545 3.27273
153 4XQC NAD 0.02151 0.40666 3.27273
154 4XQC 13D 0.03064 0.40013 3.27273
155 4JLS 3ZE 0.02588 0.40051 3.28947
156 5E1M PRO PRO LYS ARG ILE ALA 0.0000865 0.5082 3.3195
157 5E1M SAH 0.0000865 0.5082 3.3195
158 4YMH SAH 0.0002217 0.45144 3.33333
159 3EGI ADP 0.0004828 0.48781 3.39806
160 3LCC SAH 0.000008688 0.51719 3.40426
161 5E8J SAH 0.00001039 0.54093 3.63636
162 1Z3C SA8 0.00001355 0.53836 3.63636
163 3TKA SAM 0.00001794 0.51643 3.63636
164 3LST SAH 0.00006355 0.50483 3.63636
165 1XDS SAM 0.0001052 0.49477 3.63636
166 5X62 SAH 0.00007224 0.49078 3.63636
167 5E9W SAH 0.00003134 0.47336 3.63636
168 1TPY SAH 0.0002503 0.46876 3.63636
169 1KPH SAH 0.0002636 0.46778 3.63636
170 4AZT SAM 0.0003383 0.45668 3.63636
171 5JGL SAM 0.000353 0.45089 3.63636
172 1L1E SAH 0.0002227 0.44951 3.63636
173 4AZW SAM 0.0006649 0.44622 3.63636
174 1XHL NDP 0.002178 0.4414 3.63636
175 1KPG SAH 0.0002806 0.43992 3.63636
176 3LCV SAM 0.00141 0.43776 3.63636
177 1UWK NAD 0.005635 0.43607 3.63636
178 5JDI NAP 0.00283 0.43218 3.63636
179 4CME NAP 0.002933 0.43148 3.63636
180 4CLO NAP 0.002939 0.43001 3.63636
181 4CLR NAP 0.003236 0.42956 3.63636
182 5JDC NAP 0.003237 0.42955 3.63636
183 4CM9 NAP 0.003699 0.42831 3.63636
184 5K6A NAP 0.003888 0.42733 3.63636
185 3JQ9 NAP 0.003897 0.42728 3.63636
186 1REO FAD 0.006884 0.42633 3.63636
187 1E1M FAD 0.01551 0.42052 3.63636
188 2E5V FAD 0.01345 0.41636 3.63636
189 4MIG G3F 0.01686 0.41577 3.63636
190 1R6D NAD 0.02225 0.41288 3.63636
191 3NT6 FAD 0.01379 0.41122 3.63636
192 1R6D DAU 0.0237 0.41083 3.63636
193 3LRE ADP 0.0237 0.41021 3.63636
194 3CH6 NAP 0.03723 0.40638 3.63636
195 3CH6 311 0.03723 0.40638 3.63636
196 1Q9I TEO 0.03516 0.40514 3.63636
197 3NUG NAD 0.002391 0.43824 3.64372
198 4XUC 43G 0.0003489 0.48042 3.66972
199 4XUC SAM 0.0003489 0.48042 3.66972
200 2VZ0 NAP 0.01816 0.42925 3.73134
201 2VZ0 D64 0.01816 0.42925 3.73134
202 2WD7 NAP 0.003547 0.42776 3.73134
203 5N5D SAM 0.001009 0.43839 3.9823
204 2EFJ SAH 0.00001646 0.5055 4
205 2DPM SAM 0.00007553 0.4915 4
206 3M6W SAM 0.0001647 0.48032 4
207 1I8T FAD 0.003106 0.44248 4
208 1MO9 KPC 0.01192 0.44003 4
209 2WPF FAD 0.01564 0.43921 4
210 4REP FAD 0.00403 0.4372 4
211 2WPF WPF 0.02912 0.4265 4
212 1KEW NAD 0.01599 0.41841 4
213 5L4S 6KX 0.01304 0.41135 4
214 5L4S NAP 0.01304 0.41135 4
215 4D7E FAD 0.01433 0.40843 4
216 3DUW SAH 0.001022 0.43815 4.03587
217 3T7S SAM 0.00001849 0.51086 4.10448
218 3DXY SAM 0.0005525 0.46698 4.12844
219 4MKF AP5 0.01772 0.40707 4.14747
220 3FB4 AP5 0.02099 0.40266 4.16667
221 1G60 SAM 0.000008182 0.5163 4.23077
222 1G6H ADP 0.018 0.41894 4.28016
223 4KRG SAH 0.00001602 0.50624 4.36364
224 4DMG SAM 0.00008542 0.50509 4.36364
225 3DMH SAM 0.00003044 0.48337 4.36364
226 3S1S SAH 0.00006997 0.45553 4.36364
227 3CBG SAH 0.0006002 0.45045 4.36364
228 1MXH DHF 0.004161 0.4355 4.36364
229 1XKQ NDP 0.003355 0.4341 4.36364
230 3DMH GMP 0.00005042 0.43336 4.36364
231 1MXH NAP 0.004943 0.43202 4.36364
232 3V1U NAD 0.002441 0.43057 4.36364
233 3CGD NAD 0.01757 0.43049 4.36364
234 3CGD COA 0.01757 0.43049 4.36364
235 3CGD FAD 0.01757 0.43049 4.36364
236 2XVE FAD 0.01866 0.42064 4.36364
237 2XVF FAD 0.008416 0.42021 4.36364
238 1Y8Q ATP 0.0004656 0.41699 4.36364
239 2PD4 DCN 0.01179 0.4113 4.36364
240 2PD4 NAD 0.01252 0.4101 4.36364
241 3NTD FAD 0.01502 0.40948 4.36364
242 2XT3 ADP 0.02116 0.40707 4.36364
243 5THQ NDP 0.003628 0.42869 4.41176
244 1UZN NAP 0.003617 0.40423 4.45344
245 1EDO NAP 0.01335 0.40545 4.5082
246 3HVJ 705 0.00007462 0.51537 4.52489
247 3RKR NAP 0.0006513 0.46911 4.58015
248 3WV8 ATP 0.003697 0.41402 4.58716
249 4FZV SAM 0.0000008061 0.57495 4.60251
250 3JWH SAH 0.00003303 0.47272 4.60829
251 2ZAT NAP 0.01256 0.40425 4.61538
252 3G2O SAM 0.00001262 0.51797 4.68227
253 5LOG SAH 0.0001777 0.47098 4.72103
254 1DL5 SAH 0.000001265 0.57858 4.72727
255 2EG5 SAH 0.000007908 0.54637 4.72727
256 4PNE SAH 0.00001716 0.52186 4.72727
257 2PT9 S4M 0.00007815 0.4969 4.72727
258 2PT9 2MH 0.0001526 0.4969 4.72727
259 1BXK NAD 0.001209 0.4488 4.72727
260 4MO2 FDA 0.00264 0.44359 4.72727
261 1ORR NAD 0.002341 0.44126 4.72727
262 4J1Q NDP 0.003295 0.42778 4.72727
263 4Z24 FAD 0.008457 0.42501 4.72727
264 1FEC FAD 0.01109 0.42291 4.72727
265 1SB8 UD2 0.01536 0.41999 4.72727
266 1SB8 NAD 0.01327 0.41999 4.72727
267 1N4W FAD 0.02419 0.40423 4.72727
268 2DKH 3HB 0.0212 0.4034 4.72727
269 2DKH FAD 0.01566 0.4034 4.72727
270 5MZI FYK 0.0475 0.4005 4.72727
271 5MZI FAD 0.0462 0.4005 4.72727
272 4QTU SAM 0.000001035 0.55273 4.80769
273 3GEG NAD 0.002079 0.43674 4.8583
274 2VDV SAM 0.000007554 0.54728 4.87805
275 4NEC SAH 0.00001478 0.52728 4.92424
276 1ZGA SAH 0.00008615 0.46351 5.04202
277 4N49 SAM 0.00000001132 0.65543 5.09091
278 1KYQ NAD 0.001442 0.43375 5.09091
279 5CG1 NAD BBN 0.01184 0.43102 5.09091
280 3O26 NDP 0.007869 0.41346 5.09091
281 2WSB NAD 0.006262 0.42925 5.11811
282 3FRH SAH 0.0007144 0.45073 5.13834
283 5DLY 5D7 0.0007865 0.47031 5.26316
284 5DLY SAH 0.0007003 0.47031 5.26316
285 1R18 SAH 0.000002447 0.51825 5.28634
286 4CS9 AMP 0.007839 0.43737 5.29101
287 1QG6 NAD 0.009017 0.4246 5.36398
288 1QG6 TCL 0.009017 0.4246 5.36398
289 4DCM SAM 0.0001419 0.46059 5.45455
290 5TTJ FAD 0.002088 0.45053 5.45455
291 1JNR FAD 0.01432 0.4334 5.45455
292 4USR FAD 0.005204 0.42537 5.45455
293 2BRY FAD 0.006271 0.42166 5.45455
294 3UOY NAP 0.02395 0.41887 5.45455
295 3UOY FAD 0.02395 0.41887 5.45455
296 4ZCC FAD 0.01916 0.4146 5.45455
297 4ZCC NAI 0.01916 0.4146 5.45455
298 2IZ1 ATR 0.0213 0.40757 5.45455
299 1I0B PEL 0.01497 0.40517 5.45455
300 1W8D NAP 0.001247 0.40294 5.45455
301 1WMA AB3 0.02602 0.40271 5.45455
302 1WMA NDP 0.02602 0.40271 5.45455
303 4RDH AMP 0.009138 0.40201 5.45455
304 4POO SAM 0.00005159 0.50292 5.5
305 4BLW AMP 0.0001097 0.50346 5.53633
306 4BLW SAH 0.00007913 0.49852 5.53633
307 3SJ7 NDP 0.01102 0.40555 5.55556
308 5DM1 5D7 0.0001201 0.50838 5.61798
309 5DM1 SAH 0.0001127 0.50838 5.61798
310 1GOJ ADP 0.01425 0.42517 5.6338
311 1C3V PDC 0.01848 0.40792 5.71429
312 1VE3 SAM 0.0003108 0.45826 5.72687
313 1Q0S SAH 0.00000558 0.54556 5.79151
314 1WY7 SAH 0.000005053 0.5428 5.7971
315 1G55 SAH 0.0000006543 0.56164 5.81818
316 1YXM ADE 0.00004122 0.54385 5.81818
317 4KRI SAH 0.00002377 0.51111 5.81818
318 3VYW SAM 0.00005356 0.47497 5.81818
319 4TM3 FAD 0.01052 0.43726 5.81818
320 2FK8 SAM 0.0004699 0.43677 5.81818
321 1PN0 FAD 0.009286 0.42742 5.81818
322 1PN0 IPH 0.009655 0.42742 5.81818
323 4Q9N NAI 0.004419 0.42612 5.81818
324 4IRP UDP 0.0212 0.40694 5.9761
325 4Q3F TLA 0.01888 0.40982 5.98291
326 2AE2 NAP 0.001809 0.45451 6.15385
327 2AE2 PTO 0.001809 0.45451 6.15385
328 5L53 NAP 0.007258 0.40482 6.17284
329 5DX1 SFG 0.0000061 0.54603 6.18182
330 1NW5 SAM 0.000005416 0.53644 6.18182
331 5DX8 SFG 0.00002123 0.5178 6.18182
332 5DWQ SFG 0.0000249 0.51688 6.18182
333 5DX0 SFG 0.00004078 0.50943 6.18182
334 5DXA SFG 0.00002409 0.47041 6.18182
335 2GVC FAD 0.005129 0.42566 6.18182
336 3GDN HBX 0.01208 0.4243 6.18182
337 3GDN FAD 0.008755 0.4243 6.18182
338 4NTD FAD 0.0139 0.41106 6.18182
339 1E6E FAD 0.008707 0.41847 6.25
340 4BQS ADP 0.016 0.40197 6.25
341 3BXO SAM 0.00006312 0.46956 6.27615
342 2CBZ ATP 0.01265 0.42943 6.32911
343 2GDZ NAD 0.003776 0.4279 6.36704
344 3MQ2 SAH 0.0008713 0.44335 6.42202
345 2UYQ SAM 0.0000442 0.54837 6.54545
346 4LWP SAH 0.0000402 0.49638 6.54545
347 4USQ FAD 0.003552 0.43418 6.54545
348 1XSE NDP 0.005568 0.43164 6.54545
349 5G3U FDA 0.01039 0.41697 6.54545
350 1KNR FAD 0.01562 0.41059 6.54545
351 1R37 NAD 0.01193 0.40997 6.54545
352 4O1M NAD 0.009613 0.40952 6.54545
353 4BWL MN9 0.02355 0.4041 6.54545
354 2XYQ SAH 0.0001081 0.47795 6.55738
355 1EJ0 SAM 0.0000002062 0.59465 6.66667
356 5KOK SAH 0.000001994 0.55518 6.90909
357 5KOK R9T 0.00006414 0.51265 6.90909
358 5KOK S9T 0.00008508 0.50853 6.90909
359 4Y2H SAH 0.0001293 0.50688 6.90909
360 4Y2H 49K 0.0001472 0.50426 6.90909
361 2JHP SAH 0.0001829 0.47309 6.90909
362 5KMS FAD 0.006659 0.42387 6.90909
363 5BVA FAD 0.01612 0.41348 6.90909
364 5KMS NAD 0.02872 0.41012 6.90909
365 3LXD FAD 0.01864 0.40207 6.90909
366 2AG5 NAD 0.005214 0.42156 6.91057
367 5ITV NAI 0.001814 0.44368 7.05882
368 3Q87 SAM 0.0001826 0.43805 7.2
369 1KYZ SAH 0.0002868 0.45976 7.27273
370 1KYZ FER 0.001187 0.44766 7.27273
371 5EB4 FAD 0.006778 0.42763 7.27273
372 4YAG NAI 0.01904 0.40833 7.27273
373 2OBM ADP 0.03337 0.40081 7.27273
374 4MKG AP5 0.02008 0.40357 7.37327
375 2AQJ FAD 0.01071 0.43185 7.43494
376 2AQJ TRP 0.01037 0.43185 7.43494
377 4FC7 COA 0.003366 0.44389 7.63636
378 4FC7 NAP 0.003366 0.44389 7.63636
379 4CNK FAD 0.004442 0.43418 7.63636
380 1W6U NAP 0.002385 0.4294 7.63636
381 4AT0 FAD 0.03046 0.4026 7.63636
382 4YSX FAD 0.01009 0.42046 7.69231
383 4IWN GEK 0.00002637 0.51367 7.86026
384 3EGV SAH 0.0002332 0.46845 7.87402
385 2NXE SAM 0.0002338 0.46357 7.87402
386 2PXX SAH 0.000007175 0.51812 7.90698
387 5MW4 5JU 0.000006067 0.57025 8
388 3PT9 SAH 0.0000009415 0.56635 8
389 3QOX SAH 0.00001614 0.52303 8
390 3C6K SPD 0.000252 0.48959 8
391 3C6K MTA 0.000252 0.48959 8
392 3NDJ JHZ 0.01472 0.41703 8
393 4YRY FAD 0.0136 0.41525 8
394 4YRY NAD 0.02402 0.40682 8
395 2YY7 NAD 0.002555 0.43693 8.36364
396 5J7X FAD 0.01875 0.40497 8.36364
397 1N2X SAM 0.000000684 0.5307 8.72727
398 3CTY FAD 0.008946 0.42565 8.72727
399 1GPE FAD 0.01259 0.41945 8.72727
400 5GT9 NAP 0.006295 0.41914 8.74525
401 1GXU 2HP 0.004409 0.41275 8.79121
402 3C3Y SAH 0.00009912 0.48192 8.86076
403 1UAY ADN 0.0009223 0.4515 9.09091
404 1BZL FAD 0.01353 0.44289 9.09091
405 3F8D FAD 0.02189 0.4225 9.09091
406 5I39 FAD 0.01633 0.40778 9.09091
407 4M73 SAH 0.00007292 0.51446 9.45455
408 5XVQ SAH 0.0004132 0.42728 9.45455
409 3QWI CUE 0.02132 0.40511 9.62963
410 3QWI NAP 0.01358 0.40511 9.62963
411 4M37 SAH 0.00002915 0.50488 9.81818
412 1ZQ9 SAM 0.0006936 0.4433 9.81818
413 1RP0 AHZ 0.01003 0.41114 9.81818
414 2JJQ SAH 0.00000165 0.57761 10.1818
415 3VC1 SAH 0.00004111 0.53139 10.1818
416 1LVL NAD 0.002489 0.40784 10.1818
417 3VC1 GST 0.00003866 0.40049 10.1818
418 5THY SAH 0.0000028 0.55146 10.5455
419 5THZ SAH 0.000005035 0.54525 10.5455
420 1D4D FAD 0.01326 0.41666 10.5455
421 5XVK SAH 0.001123 0.4421 10.9091
422 1QO8 FAD 0.01269 0.41668 10.9091
423 2HMT NAI 0.002652 0.42396 11.1111
424 1NV8 MEQ 0.0001 0.49577 11.2676
425 1NV8 SAM 0.0001092 0.49577 11.2676
426 5HSA FAS 0.009604 0.42148 11.2727
427 1L3I SAH 0.000001582 0.57425 11.4583
428 2XVM SAH 0.00001073 0.49666 11.5578
429 3OFK SAH 0.004891 0.41045 11.5741
430 2YX1 SFG 0.0000002696 0.55831 11.6364
431 2VVM FAD 0.003119 0.44344 11.6364
432 5XLX SAH 0.004243 0.40951 11.6364
433 4NTC FAD 0.01924 0.40722 11.6418
434 3A4T SFG 0.000002856 0.517 11.6788
435 1RZ1 NAD 0.01145 0.41899 11.8012
436 3H2B SAH 0.00005085 0.49444 11.8227
437 1FP2 SAH 0.002457 0.44274 12
438 4YNU FAD 0.01433 0.41592 12
439 4YNU LGC 0.01674 0.41592 12
440 1JG3 ADN 0.000234 0.46355 12.3404
441 3AFN NAP 0.01269 0.40761 12.4031
442 4D42 NAP 0.008699 0.4304 12.4113
443 4D42 W0I 0.008699 0.4304 12.4113
444 5FA8 SAM 0.00001957 0.51935 12.4224
445 2F5Z FAD 0.01832 0.40998 12.5
446 5JE0 AZ8 0.0000121 0.54236 12.5506
447 5JE0 SAH 0.0000121 0.54236 12.5506
448 2PZM NAD 0.01525 0.41378 12.7273
449 2PZM UDP 0.01525 0.41378 12.7273
450 1U2Z SAH 0.00008372 0.49163 12.933
451 4TXI FAD 0.004273 0.42806 13.0909
452 5FTW SAH 0.0003525 0.4411 13.2812
453 4KIB SAH 0.0000181 0.5038 13.4454
454 3S5W FAD 0.001657 0.44546 13.4545
455 2ZWA SAH 0.0008432 0.42074 13.4545
456 3OU2 SAH 0.00002235 0.45835 13.7615
457 1I9G SAM 0.000005089 0.5402 13.8182
458 5JCA FAD 0.01028 0.421 14.0845
459 5JCA NDP 0.02094 0.4188 14.0845
460 3MB5 SAM 0.000000763 0.52921 14.1176
461 2GAG NAD 0.006061 0.42684 14.1414
462 2GAG FAD 0.01124 0.42179 14.1414
463 2GAG FOA 0.01124 0.42179 14.1414
464 4IEE AGS 0.01209 0.41213 14.1818
465 5K7U SAM 0.0002384 0.4632 14.2222
466 3FGZ BEF 0.02945 0.40408 14.8438
467 1F3L SAH 0.00002217 0.47986 14.9091
468 5IL1 SAM 0.0003047 0.45863 15.0943
469 1IM8 SAI 0.000004704 0.51458 15.9836
470 2BZG SAH 0.000108 0.47797 16
471 1O5I NAD 0.003335 0.41596 16.0643
472 1T57 FMN 0.003913 0.41657 16.5049
473 4QED NAP 0.004687 0.42366 16.5323
474 2PWY SAH 0.0000007249 0.58221 20.155
475 3AD8 FAD 0.01154 0.43407 23.2323
476 3AD8 PYC 0.01154 0.43407 23.2323
477 3AD8 NAD 0.004823 0.42807 23.2323
478 1LSS NAD 0.0004219 0.43745 29.2857
479 5FA5 MTA 0.00004428 0.48085 30
480 4GQB 0XU 0.000002385 0.56185 50
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