Receptor
PDB id Resolution Class Description Source Keywords
1VKO 2.3 Å EC: 5.5.1.4 CRYSTAL STRUCTURE OF INOSITOL-3-PHOSPHATE SYNTHASE (CE21227) CAENORHABDITIS ELEGANS AT 2.30 A RESOLUTION CAENORHABDITIS ELEGANS CE21227 INOSITOL-3-PHOSPHATE SYNTHASE STRUCTURAL GENOMICSPROTEIN STRUCTURE INITIATIVE PSI JOINT CENTER FOR STRUCTUGENOMICS ISOMERASE
Ref.: CRYSTAL STRUCTURE OF INOSITOL-3-PHOSPHATE SYNTHASE FROM CAENORHABDITIS ELEGANS AT 2.30 A RESOLUTION TO BE PUBLISHED
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:527;
A:528;
Invalid;
Invalid;
none;
none;
submit data
35.453 Cl [Cl-]
IOD A:529;
A:530;
Invalid;
Invalid;
none;
none;
submit data
126.904 I [I-]
K A:526;
Part of Protein;
none;
submit data
39.098 K [K+]
NAD A:601;
Valid;
none;
submit data
663.425 C21 H27 N7 O14 P2 c1cc(...
POP A:602;
Invalid;
none;
submit data
175.959 H2 O7 P2 O[P@@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1VKO 2.3 Å EC: 5.5.1.4 CRYSTAL STRUCTURE OF INOSITOL-3-PHOSPHATE SYNTHASE (CE21227) CAENORHABDITIS ELEGANS AT 2.30 A RESOLUTION CAENORHABDITIS ELEGANS CE21227 INOSITOL-3-PHOSPHATE SYNTHASE STRUCTURAL GENOMICSPROTEIN STRUCTURE INITIATIVE PSI JOINT CENTER FOR STRUCTUGENOMICS ISOMERASE
Ref.: CRYSTAL STRUCTURE OF INOSITOL-3-PHOSPHATE SYNTHASE FROM CAENORHABDITIS ELEGANS AT 2.30 A RESOLUTION TO BE PUBLISHED
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1VKO - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1VKO - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
50% Homology Family (7)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1VKO - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 1P1K - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
3 1P1I - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 1P1H - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
5 1RM0 Ki = 0.67 uM D6P C7 H15 O7 P C(CO)[C@H]....
6 1P1J - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
7 1JKI Ki = 6 uM DG6 C6 H15 O8 P C(CO)[C@H]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAD; Similar ligands found: 220
No: Ligand ECFP6 Tc MDL keys Tc
1 A3D 0.872727 0.986111
2 NAD IBO 0.845455 0.933333
3 NHD 0.821429 0.972222
4 NAP 0.811966 0.986111
5 NAJ PYZ 0.803419 0.910256
6 NFD 0.791304 0.946667
7 NXX 0.765766 0.972603
8 DND 0.765766 0.972603
9 ZID 0.737705 0.986111
10 NAQ 0.729508 0.934211
11 NAE 0.721311 0.959459
12 NA0 0.712 0.972603
13 TAP 0.704 0.921053
14 AMP NAD 0.696 0.945946
15 NDE 0.689922 0.972603
16 NAJ 0.683333 0.972222
17 NDC 0.679389 0.934211
18 NDO 0.674603 0.958904
19 N01 0.656 0.972222
20 CNA 0.642276 0.972603
21 NBP 0.621212 0.922078
22 NAD BBN 0.609929 0.876543
23 8ID 0.609756 0.922078
24 NAD CJ3 0.601399 0.845238
25 ADP MG 0.579439 0.918919
26 A2D 0.576923 0.958333
27 ADP 0.575472 0.931507
28 NGD 0.574803 0.922078
29 BEF ADP 0.574074 0.894737
30 ADP BEF 0.574074 0.894737
31 BA3 0.566038 0.958333
32 NAD NDT 0.565789 0.755319
33 M33 0.564815 0.918919
34 ADP PO3 0.563636 0.957747
35 B4P 0.560748 0.958333
36 AP5 0.560748 0.958333
37 ATP MG 0.558559 0.918919
38 AN2 0.555556 0.918919
39 GAP 0.553571 0.932432
40 OOB 0.551724 0.972222
41 CA0 0.550459 0.932432
42 ATP 0.545455 0.931507
43 ACP 0.545455 0.906667
44 NAD TDB 0.544872 0.70297
45 ADP ALF 0.54386 0.883117
46 ALF ADP 0.54386 0.883117
47 5FA 0.540541 0.931507
48 AQP 0.540541 0.931507
49 APR 0.540541 0.931507
50 AR6 0.540541 0.931507
51 ANP MG 0.53913 0.907895
52 VO4 ADP 0.53913 0.945205
53 ADP VO4 0.53913 0.945205
54 AGS 0.535714 0.883117
55 SAP 0.535714 0.883117
56 AD9 0.535714 0.906667
57 WAQ 0.533333 0.896104
58 ABM 0.53271 0.905405
59 00A 0.529412 0.921053
60 DLL 0.529412 0.972222
61 ANP 0.526316 0.906667
62 NJP 0.526316 0.959459
63 ACQ 0.526316 0.906667
64 OAD 0.525 0.932432
65 AMP MG 0.523364 0.905405
66 ADX 0.522523 0.839506
67 5AL 0.521739 0.945205
68 A1R 0.521008 0.871795
69 9SN 0.520325 0.909091
70 AMP 0.518868 0.930556
71 A 0.518868 0.930556
72 50T 0.517857 0.893333
73 ATF 0.517241 0.894737
74 DAL AMP 0.516949 0.945205
75 3OD 0.516393 0.932432
76 1ZZ 0.516393 0.851852
77 SON 0.513514 0.92
78 PRX 0.513274 0.881579
79 SRP 0.512821 0.92
80 ADP BMA 0.512397 0.932432
81 3UK 0.512397 0.958904
82 MYR AMP 0.512195 0.851852
83 NAJ PZO 0.510949 0.909091
84 NMN 0.509434 0.875
85 AMP DBH 0.507937 0.906667
86 A22 0.504202 0.945205
87 FA5 0.504 0.945946
88 ATP A A A 0.504 0.971831
89 TYR AMP 0.5 0.945946
90 8QN 0.5 0.945205
91 NAX 0.496183 0.886076
92 PR8 0.495935 0.8625
93 PAJ 0.495868 0.873418
94 4AD 0.495868 0.933333
95 AMO 0.495868 0.92
96 ADQ 0.495868 0.932432
97 A12 0.495495 0.894737
98 AP2 0.495495 0.894737
99 ALF ADP 3PG 0.492424 0.873418
100 LA8 ALF 3PG 0.492424 0.873418
101 AHZ 0.492308 0.851852
102 YAP 0.492063 0.933333
103 FYA 0.491935 0.918919
104 AHX 0.491803 0.884615
105 4UU 0.488372 0.933333
106 5SV 0.487603 0.8375
107 TAT 0.487179 0.894737
108 APC 0.486957 0.894737
109 SRA 0.486239 0.881579
110 NAI 0.484848 0.921053
111 6V0 0.484848 0.909091
112 GTA 0.484615 0.898734
113 A A 0.483871 0.958333
114 LAD 0.483871 0.873418
115 AU1 0.482456 0.906667
116 TXE 0.481203 0.921053
117 AF3 ADP 3PG 0.481203 0.873418
118 OMR 0.481203 0.841463
119 LAQ 0.480916 0.851852
120 G3A 0.48062 0.909091
121 TXA 0.48 0.92
122 NB8 0.48 0.884615
123 ME8 0.48 0.851852
124 BIS 0.48 0.871795
125 PTJ 0.48 0.884615
126 139 0.477941 0.886076
127 LPA AMP 0.477273 0.851852
128 AR6 AR6 0.476923 0.958333
129 G5P 0.476923 0.909091
130 AFH 0.476923 0.873418
131 25L 0.47619 0.945205
132 25A 0.47541 0.958333
133 DZD 0.47482 0.897436
134 TXD 0.473684 0.921053
135 4UV 0.472868 0.933333
136 TYM 0.470149 0.945946
137 ADV 0.470085 0.894737
138 RBY 0.470085 0.894737
139 ARG AMP 0.469697 0.841463
140 4TA 0.467626 0.864198
141 48N 0.466165 0.884615
142 XAH 0.465116 0.851852
143 4UW 0.462687 0.897436
144 M24 0.461538 0.886076
145 IOT 0.459854 0.821429
146 T5A 0.456522 0.853659
147 EAD 0.455782 0.886076
148 MAP 0.455285 0.883117
149 BT5 0.453901 0.821429
150 A4P 0.452555 0.833333
151 UP5 0.451852 0.933333
152 PAP 0.445378 0.917808
153 AP0 0.445255 0.884615
154 4TC 0.445255 0.909091
155 YLP 0.444444 0.831325
156 P1H 0.443709 0.864198
157 AOC 0.442478 0.810811
158 Z5A 0.439189 0.833333
159 2A5 0.436975 0.857143
160 G A A A 0.43662 0.909091
161 COD 0.43662 0.802326
162 ADJ 0.435714 0.841463
163 YLC 0.434783 0.851852
164 YLB 0.434783 0.831325
165 U A G G 0.433566 0.921053
166 ATR 0.433333 0.90411
167 7MD 0.432836 0.851852
168 G5A 0.429752 0.790698
169 PO4 PO4 A A A A PO4 0.429688 0.943662
170 TAD 0.42963 0.873418
171 5AS 0.42735 0.770115
172 BTX 0.426573 0.831325
173 YLA 0.425532 0.831325
174 DSZ 0.425197 0.790698
175 NCN 0.424779 0.805556
176 UPA 0.42446 0.921053
177 VMS 0.424 0.8
178 54H 0.424 0.8
179 N0B 0.422819 0.853659
180 6AD 0.422764 0.85
181 AYB 0.422535 0.821429
182 7D3 0.422414 0.844156
183 YLY 0.421769 0.821429
184 TSB 0.420635 0.809524
185 ODP 0.41958 0.922078
186 AV2 0.419355 0.855263
187 FB0 0.419355 0.775281
188 A5A 0.419355 0.819277
189 NNR 0.419048 0.739726
190 A A A 0.418605 0.918919
191 LEU LMS 0.418605 0.793103
192 649 0.417266 0.775281
193 NMN AMP PO4 0.416667 0.933333
194 SSA 0.416 0.790698
195 P5A 0.415385 0.755556
196 LSS 0.414062 0.772727
197 A2R 0.412698 0.918919
198 52H 0.412698 0.790698
199 JB6 0.412214 0.896104
200 5N5 0.411215 0.783784
201 YSA 0.410448 0.811765
202 5CA 0.409449 0.790698
203 53H 0.409449 0.790698
204 ITT 0.408333 0.878378
205 7D4 0.408333 0.844156
206 NA7 0.407692 0.894737
207 5CD 0.407407 0.794521
208 0WD 0.406897 0.909091
209 A3P 0.40678 0.930556
210 AVV 0.40625 0.860759
211 RAB 0.40566 0.808219
212 ADN 0.40566 0.808219
213 XYA 0.40566 0.808219
214 FDA 0.405063 0.823529
215 GSU 0.40458 0.790698
216 7MC 0.404255 0.831325
217 NSS 0.403101 0.811765
218 6FA 0.402516 0.853659
219 NVA LMS 0.4 0.793103
220 PPS 0.4 0.817073
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1VKO; Ligand: NAD; Similar sites found: 534
This union binding pocket(no: 1) in the query (biounit: 1vko.bio1) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4E13 NAD 0.0000863 0.42056 0.706714
2 1V59 FAD 0.002552 0.41665 1.04603
3 1F8F NAD 0.0004061 0.41319 1.07817
4 4OOE NDP 0.0005318 0.41109 1.23762
5 2RGJ FAD 0.001677 0.41051 1.24378
6 1UWK URO 0.000139 0.46556 1.30354
7 2Z3Y F2N 0.002836 0.41299 1.30354
8 3CIF NAD 0.0001195 0.44136 1.39276
9 3CIF G3H 0.0004063 0.43597 1.39276
10 1REO FAD 0.004772 0.40038 1.44033
11 4JJF N2I 0.001108 0.41041 1.45349
12 4JJF FE9 0.000795 0.40991 1.45349
13 2IMP NAI 0.000003773 0.40939 1.46138
14 3AYI FAD 0.007145 0.40422 1.48976
15 3AYI HCI 0.007468 0.40422 1.48976
16 2GSD NAD 0.00003107 0.47759 1.49254
17 2DBZ NAP 0.0000196 0.46895 1.49701
18 1ZK7 FAD 0.005811 0.4028 1.49893
19 3TI8 LNV 0.00004698 0.43944 1.51899
20 2NAD NAD 0.00003529 0.47553 1.52672
21 1LVL FAD 0.001595 0.42261 1.52838
22 2BRY FAD 0.001809 0.40929 1.60966
23 1RLZ NAD 0.00000009778 0.43025 1.62602
24 3ABI NAD 0.0000102 0.48305 1.64384
25 1BZL FAD 0.008494 0.42209 1.64609
26 3Q3C NAD 0.0002016 0.42056 1.67224
27 4B63 ORN 0.00000003692 0.47845 1.67598
28 4B63 NAP 0.00000004206 0.47845 1.67598
29 4B63 FAD 0.00000003692 0.47845 1.67598
30 3UCL NAP 0.001673 0.43952 1.67598
31 3UCL CYH 0.001815 0.43606 1.67598
32 2WA4 069 0.005672 0.44387 1.7192
33 1Q0H NDP 0.0005594 0.44414 1.72414
34 1Q0H FOM 0.0006103 0.4407 1.72414
35 1KPG SAH 0.005557 0.41316 1.74216
36 3E1T FAD 0.00253 0.4149 1.75781
37 2CDU FAD 0.002786 0.40594 1.76991
38 2CDU ADP 0.00008614 0.4014 1.76991
39 1GET NAP 0.009614 0.40849 1.77778
40 1GET FAD 0.008979 0.40849 1.77778
41 1RM4 NDP 0.000621 0.41205 1.78042
42 3QV1 NAD 0.0008307 0.40988 1.78042
43 1ME8 RVP 0.0000004525 0.42652 1.78926
44 3MJE NDP 0.0002843 0.43101 1.81452
45 1NYT NAP 0.0008026 0.40385 1.84502
46 4K28 NAD 0.00001978 0.45548 1.85874
47 4HXY NDP 0.0001269 0.44717 1.8622
48 4PIV NDP 0.0002164 0.43872 1.8622
49 4D04 NAP 0.003116 0.42518 1.8622
50 1DJN ADP 0.0003535 0.406 1.8622
51 3C6K SPD 0.003984 0.40012 1.8622
52 1OMO NAD 0.00002175 0.45071 1.86335
53 1EZ4 NAD 0.00001716 0.46156 1.88679
54 2P8B NSK 0.0000004617 0.44306 1.89702
55 1ZEM NAD 0.00000447 0.48218 1.9084
56 3GDN FAD 0.001468 0.42298 1.91939
57 3GDN HBX 0.002358 0.4224 1.91939
58 2YY7 NAD 0.00001723 0.47851 1.92308
59 1OAA OAA 0.003154 0.41121 1.9305
60 1SAY PYR 0.00004202 0.47121 1.93906
61 2RAB FAD 0.003326 0.41127 1.94384
62 2RAB NAD 0.00794 0.41067 1.94384
63 1H2B NAJ 0.0001345 0.45101 1.94986
64 4EMI NAD 0.008476 0.40629 1.95122
65 1PL6 572 0.0005166 0.42802 1.96629
66 1PL6 NAD 0.00006256 0.42178 1.96629
67 4HA6 FAD 0.002238 0.41695 1.9685
68 1SB8 UD2 0.0003648 0.45517 1.98864
69 1SB8 NAD 0.0003225 0.45345 1.98864
70 1KEV NDP 0.0007347 0.42508 1.9943
71 1X7D ORN 0.00005204 0.47207 2
72 1X7D NAD 0.00001778 0.4697 2
73 2NPX NAD 0.00431 0.41669 2.01342
74 2VVM FAD 0.004501 0.40236 2.0202
75 2VVL FAD 0.004976 0.40168 2.0202
76 4CNK FAD 0.002232 0.41181 2.04604
77 3IHG FAD 0.001422 0.40299 2.05607
78 1MUU NAD 0.0002628 0.41709 2.06422
79 3V1Y NAD 0.0001073 0.43515 2.07715
80 3JQF NAP 0.001029 0.41125 2.08333
81 3BMQ NAP 0.00114 0.40958 2.08333
82 3BMN NAP 0.001171 0.40936 2.08333
83 3JQ8 NAP 0.001264 0.40812 2.08333
84 3JQ9 NAP 0.001458 0.40592 2.08333
85 3SQP FAD 0.02116 0.42167 2.09205
86 1Z6Z NAP 0.00199 0.40146 2.12766
87 1XG5 NAP 0.0008646 0.41711 2.15054
88 4PQG UDP 0.007559 0.41349 2.15264
89 4EUE NAI 0.0006114 0.42533 2.15311
90 1MXH DHF 0.003692 0.40355 2.17391
91 2CDC XYP 0.005012 0.41816 2.18579
92 2CDC XYS 0.008278 0.40931 2.18579
93 4G74 UQ5 0.005202 0.4064 2.19124
94 4G74 FAD 0.002788 0.40593 2.19124
95 1A5Z NAD 0.00001165 0.44362 2.19436
96 1AE1 NAP 0.001824 0.40916 2.1978
97 2YVF NAD 0.008776 0.40635 2.20588
98 2YVF FAD 0.008809 0.40562 2.20588
99 1E5Q NDP 0.00018 0.43564 2.22222
100 3QWI CUE 0.001167 0.42575 2.22222
101 3QWI NAP 0.0006249 0.42498 2.22222
102 3RNM FAD 0.004837 0.40406 2.22222
103 1I2B NAD 0.0003015 0.46024 2.22772
104 1I2B UPG 0.000001796 0.43837 2.22772
105 1I2B USQ 0.000001796 0.43837 2.22772
106 4DPL NAP 0.0004608 0.42551 2.22841
107 3WMX NAD 0.00009727 0.43904 2.23464
108 3TN7 NJP 0.0006064 0.42273 2.23464
109 1MV8 NAD 0.0001116 0.43368 2.29358
110 3WBF NAP 0.001094 0.40803 2.29508
111 3WBF API 0.003183 0.40021 2.29508
112 1EK6 UPG 0.000877 0.4427 2.29885
113 1ORR NAD 0.0001286 0.45172 2.30548
114 5JE8 NAD 0.03737 0.4204 2.31788
115 1ZMD FAD 0.004933 0.40374 2.32068
116 1ZMD NAI 0.0007412 0.40045 2.32068
117 3ICC NAP 0.001937 0.4069 2.35294
118 3S5W FAD 0.002007 0.40314 2.37581
119 2NCD ADP 0.01473 0.44273 2.38095
120 4B7X NAP 0.00236 0.40102 2.38095
121 3ETG GLU 0.00298 0.42002 2.39521
122 3ETG GTP 0.002187 0.4183 2.39521
123 4RQU NAD 0.0007605 0.4131 2.4
124 3O03 NAP 0.00101 0.40207 2.4055
125 3D2M COA 0.0000152 0.40898 2.41228
126 1LDN NAD 0.00002264 0.47414 2.42086
127 1JQN DCO 0.0000278 0.46477 2.42086
128 2ZXI FAD 0.001405 0.41826 2.42086
129 1GTE FAD 0.008936 0.40537 2.42086
130 2RGH FAD 0.004091 0.40394 2.42086
131 4IV9 FAD 0.00421 0.40347 2.42086
132 2PZM NAD 0.0008124 0.43387 2.42424
133 4OPC PGT 0.022 0.40767 2.42826
134 2CVQ NDP 0.00001986 0.46823 2.44648
135 3FPZ AHZ 0.000000008185 0.45893 2.45399
136 1PR9 NAP 0.00156 0.41167 2.45902
137 3D3W NAP 0.001286 0.41082 2.45902
138 1K3T BRZ 0.00009024 0.45741 2.50696
139 3T31 DCQ 0.0008 0.44511 2.51716
140 3T31 FAD 0.0007299 0.44503 2.51716
141 1RSG FAD 0.004087 0.40593 2.51938
142 4FC7 NAP 0.002696 0.41286 2.52708
143 1BW9 NAD 0.0000251 0.5139 2.52809
144 1BXG NAD 0.00001739 0.46133 2.52809
145 1C1X NAD 0.00001666 0.50282 2.53521
146 3A2Y TS5 0.01822 0.41119 2.53807
147 2HK9 NAP 0.0001394 0.43268 2.54545
148 2Q0L FAD 0.004152 0.40469 2.57235
149 4BJZ P3A 0.01241 0.4051 2.59434
150 3V1U NAD 0.0006834 0.40396 2.5974
151 2GDZ NAD 0.0001796 0.43826 2.62172
152 1UP7 NAD 0.0000285 0.45049 2.63789
153 1Z44 FMN 0.02918 0.40887 2.66272
154 1CDO NAD 0.0008945 0.40503 2.6738
155 1JQ5 NAD 0.0000002432 0.4588 2.7027
156 1DSS NAD 0.0001328 0.42719 2.7027
157 3OID NDP 0.002762 0.4025 2.71318
158 1GAD NAD 0.00008289 0.43853 2.72727
159 3H8V ATP 0.00002253 0.42452 2.73973
160 3LU1 NAD 0.0002528 0.43273 2.74725
161 4USQ FAD 0.001339 0.41541 2.77008
162 3K37 BCZ 0.000005056 0.40543 2.77078
163 3F8D FAD 0.0125 0.40441 2.78638
164 4M52 FAD 0.005695 0.4004 2.7897
165 1U8X NAD 0.0001547 0.46416 2.7933
166 2QA1 FAD 0.001933 0.4107 2.8
167 1RKX NAD 0.0008018 0.42373 2.80112
168 2A8X FAD 0.004442 0.40549 2.80172
169 2YGM GLA NAG GAL FUC 0.01484 0.42497 2.82486
170 3NUG NAD 0.000285 0.43447 2.83401
171 2VDV SAM 0.01454 0.41369 2.84553
172 1GSA ADP 0.0000003926 0.40382 2.8481
173 1OC2 NAD 0.0004649 0.45365 2.87356
174 1GV0 NAD 0.00001381 0.47827 2.90323
175 4TM3 FAD 0.01009 0.40763 2.93454
176 3AY6 NAI 0.003123 0.40521 2.97398
177 3AY6 BGC 0.00668 0.4038 2.97398
178 1O0S NAI 0.00002887 0.44379 2.97521
179 3L4S NAD 0.000371 0.43331 2.97619
180 3L4S 3PG 0.0004053 0.43331 2.97619
181 2Y6Q I7T 0.001887 0.42266 2.97952
182 2Y6Q FAD 0.0007225 0.42266 2.97952
183 2RGO FAD 0.001508 0.4171 2.97952
184 4NTC FAD 0.004002 0.4053 2.98507
185 1I8T FAD 0.003791 0.40417 2.99728
186 2X3N FAD 0.002093 0.41175 3.00752
187 2GLX NDP 0.000437 0.40976 3.01205
188 2GCG NDP 0.0000126 0.47633 3.0303
189 2DTX BMA 0.0004954 0.43768 3.0303
190 4KWI NAP 0.002293 0.41351 3.04183
191 4KWI 1TJ 0.002441 0.41351 3.04183
192 4USR FAD 0.00102 0.41849 3.04709
193 3WQQ NDP 0.0003358 0.4464 3.07377
194 2Q7V FAD 0.001837 0.41823 3.07692
195 2AE2 NAP 0.002182 0.41433 3.07692
196 4N02 FNR 0.0000008404 0.40495 3.08123
197 4J4H NAI 0.0003061 0.45333 3.0888
198 4JK3 NAD 0.00003035 0.45325 3.0888
199 4J4H 1J1 0.0002849 0.45137 3.0888
200 3SSO SAH 0.001184 0.42444 3.10263
201 2PK3 A2R 0.0001266 0.40546 3.11526
202 1YY5 FAD 0.005906 0.40163 3.11891
203 1LTH NAD 0.000005662 0.47075 3.1348
204 2IXB A2G 0.0005611 0.43445 3.15315
205 2IXB NAD 0.0003078 0.43325 3.15315
206 2GZ3 NAP 0.0001625 0.46607 3.16574
207 2IVD FAD 0.002365 0.40861 3.16574
208 4J1Q NDP 0.001053 0.40475 3.16574
209 1YQZ FAD 0.00945 0.40372 3.16574
210 1R37 NAD 0.000182 0.44758 3.17003
211 3WGT QSC 0.007548 0.40091 3.17003
212 3WGT FAD 0.007191 0.40091 3.17003
213 3H9E NAD 0.00009321 0.43721 3.17919
214 3GGO NAI 0.0002073 0.4544 3.18471
215 2G5C NAD 0.00004235 0.46076 3.20285
216 2EWM NAD 0.0001315 0.44661 3.21285
217 3OYZ ACO 0.0007849 0.4114 3.23326
218 2BGM NAJ 0.00007605 0.44006 3.23741
219 3HAD NAD 0.0003246 0.45433 3.24675
220 1FEC FAD 0.001576 0.4257 3.26531
221 2VYN NAD 0.0005008 0.419 3.29341
222 1J49 NAD 0.00000484 0.4888 3.3033
223 2Q37 3AL 0.001539 0.49131 3.31492
224 3GD4 FAD 0.002779 0.42431 3.32681
225 3GD4 NAD 0.004731 0.42409 3.32681
226 4EIP K2C 0.003385 0.4128 3.35196
227 4EIP FAD 0.003681 0.40957 3.35196
228 1COY FAD 0.00386 0.4059 3.35306
229 2PV7 NAD 0.00001326 0.47107 3.3557
230 1IY8 NAD 0.0001775 0.4418 3.37079
231 1H82 FAD 0.005744 0.41098 3.38983
232 1H82 GZZ 0.006874 0.41063 3.38983
233 1XCL SAH 0.0005883 0.42594 3.40426
234 3B1F NAD 0.00013 0.41573 3.44828
235 3ZNN 4WL 0.01008 0.40121 3.45821
236 2FK8 SAM 0.006839 0.41229 3.45912
237 1WP4 NDP 0.000312 0.42365 3.46021
238 2CVZ NDP 0.0005838 0.41014 3.46021
239 1G8S MET 0.002877 0.48413 3.47826
240 3VZS NAP 0.003561 0.41012 3.50195
241 1P1C SAH 0.0003035 0.40899 3.51759
242 1G0N PHH 0.0006128 0.43643 3.53357
243 1G0N NDP 0.0005261 0.43551 3.53357
244 3UOY NAP 0.005399 0.41812 3.53818
245 1XHC FAD 0.003289 0.40324 3.53818
246 4FWE FAD 0.006056 0.4003 3.53818
247 2C29 NAP 0.001746 0.4211 3.56083
248 2C29 DQH 0.00181 0.42049 3.56083
249 2R4J FAD 0.007093 0.40435 3.59281
250 2CFC NAD 0.0005656 0.41717 3.6
251 1DXY NAD 0.000001846 0.49526 3.6036
252 2DM6 NAP 0.001237 0.42149 3.6036
253 2DM6 IMN 0.00381 0.40409 3.6036
254 3AB1 FAD 0.001467 0.42089 3.61111
255 1O6Z NAD 0.00002847 0.44783 3.63036
256 4Q0A 4OA 0.01768 0.40866 3.64238
257 1BXK NAD 0.00008814 0.44514 3.66197
258 2XVE FAD 0.002472 0.42782 3.66379
259 2XVF FAD 0.001286 0.41971 3.66379
260 1N9L FMN 0.01052 0.41777 3.66972
261 3EAU PDN 0.000008754 0.40259 3.66972
262 3EAU NDP 0.000008754 0.40259 3.66972
263 1C3V NDP 0.0001233 0.44737 3.67347
264 1EDO NAP 0.0004966 0.42865 3.68852
265 1KYQ NAD 0.00003753 0.41503 3.72439
266 3WE0 FAD 0.00297 0.41222 3.72439
267 1T26 GBD 0.0000000000005553 0.55123 3.72671
268 1T26 NAI 0.0000278 0.48897 3.72671
269 2F2U M77 0.03213 0.41384 3.73134
270 2A92 NAI 0.00004487 0.46705 3.73832
271 1U3U BNF 0.001696 0.42058 3.74332
272 1OBB NAD 0.0001003 0.42489 3.75
273 1GZ6 NAI 0.0001322 0.45299 3.76176
274 2QZZ NAP 0.002543 0.40856 3.77358
275 2QZZ EMF 0.002788 0.40816 3.77358
276 1GY8 NAD 0.000115 0.44846 3.77834
277 2GN4 UD1 0.001089 0.46342 3.77907
278 2GN4 NDP 0.001138 0.46117 3.77907
279 2NLI FMN 0.000001262 0.40486 3.80435
280 2NLI LAC 0.000002249 0.40328 3.80435
281 1YKJ FAD 0.002688 0.42777 3.80711
282 1X87 NAD 0.0001089 0.42282 3.81125
283 2WPF FAD 0.005954 0.4282 3.83838
284 2WPF WPF 0.007121 0.42625 3.83838
285 3O9Z NAD 0.00009585 0.47181 3.84615
286 3O9Z AKG 0.0001066 0.4689 3.84615
287 4L8V NAP 0.00003354 0.4637 3.85757
288 1RP0 AHZ 0.001036 0.41691 3.87324
289 2HJR APR 0.00001637 0.44922 3.91061
290 3KO8 NAD 0.0003307 0.43514 3.91061
291 3LAD FAD 0.003088 0.4106 3.91061
292 1NAA 6FA 0.003703 0.40853 3.91061
293 1NAA ABL 0.005814 0.40853 3.91061
294 4IDC 1XX 0.001332 0.41421 3.91566
295 1SS4 CIT 0.0004149 0.59946 3.92157
296 4DSG FAD 0.00899 0.40658 3.92562
297 4DSG UDP 0.01038 0.40275 3.92562
298 4FN4 NAD 0.0003758 0.42699 3.93701
299 3NYC FAD 0.005639 0.4075 3.93701
300 2O4C NAD 0.00001824 0.47774 3.94737
301 3CGD NAD 0.01809 0.40154 3.95833
302 1ZBQ NAD 0.0001524 0.44752 3.97554
303 3FZG SAM 0.003139 0.44192 4
304 1JNR FAD 0.01321 0.40565 4
305 4G1V FAD 0.00000009702 0.44998 4.01003
306 1JA9 NDP 0.0005553 0.42687 4.0146
307 3LST SAH 0.02522 0.40539 4.02299
308 2DFV NAD 0.00005169 0.45001 4.03458
309 2JAH NDP 0.0009719 0.41507 4.04858
310 2JAP NDP 0.001201 0.41182 4.04858
311 4GQB 0XU 0.0000001745 0.41735 4.06977
312 3CTY FAD 0.003262 0.4116 4.07523
313 1LLU NAD 0.0002304 0.44378 4.09683
314 1JQ3 AAT 0.001558 0.40648 4.09683
315 3A06 FOM 0.002765 0.40606 4.09683
316 3A06 NDP 0.002963 0.40259 4.09683
317 3A4V NAD 0.00004361 0.47355 4.10095
318 1VL0 NAI 0.0001765 0.42623 4.10959
319 4JNA FAD 0.003246 0.40977 4.11765
320 1R6D NAD 0.0002104 0.46552 4.1543
321 1R6D DAU 0.000247 0.46184 4.1543
322 1KEW NAD 0.0005363 0.44768 4.15512
323 1KEW TYD 0.001032 0.43561 4.15512
324 1PEA ACM 0.007068 0.47708 4.15584
325 1K97 ASP 0.000001178 0.42044 4.17582
326 1K97 CIR 0.000001178 0.42044 4.17582
327 2AG8 NAP 0.0001427 0.41077 4.18251
328 1U7T TDT 0.000243 0.45177 4.21456
329 1E3W NAD 0.0001485 0.44119 4.21456
330 1U7T NAD 0.0003903 0.41945 4.21456
331 1E6W NAD 0.0003981 0.43811 4.23077
332 3AXB PRO 0.002693 0.41288 4.24107
333 3AXB FAD 0.002337 0.40994 4.24107
334 3A28 NAD 0.0002924 0.4432 4.26357
335 2FR1 NDP 0.0001151 0.452 4.28305
336 4K5S PM0 0.004501 0.4097 4.28305
337 4K5S FAD 0.001765 0.40969 4.28305
338 1H9A NAP 0.001666 0.41188 4.3299
339 2WSB NAD 0.0003941 0.44261 4.33071
340 2RHQ GAX 0.01743 0.40051 4.42177
341 1SC6 NAD 0.00006402 0.46137 4.45545
342 2AQJ FAD 0.001298 0.43829 4.46097
343 2AQJ TRP 0.001242 0.43829 4.46097
344 4GKV NAD 0.00004376 0.47055 4.46429
345 1HKU NAD 0.00001121 0.49304 4.46927
346 4MP8 NAD 0.0002186 0.44864 4.46927
347 2DKH FAD 0.00212 0.40674 4.46927
348 2DKH 3HB 0.003741 0.40439 4.46927
349 2D2I NAP 0.00008096 0.43071 4.47368
350 2C5A NAD 0.001096 0.43719 4.48549
351 4CQM NAP 0.000138 0.44225 4.5082
352 2NVK FAD 0.002935 0.41045 4.5082
353 4NEC SAH 0.01797 0.4058 4.54545
354 4EA7 JB2 0.004931 0.40085 4.54545
355 1YJQ NAP 0.0008867 0.42074 4.62046
356 1WVC CTP 0.00001178 0.40314 4.6332
357 4J36 1HR 0.002206 0.41719 4.65549
358 4J36 FAD 0.001127 0.4169 4.65549
359 4JDR FAD 0.002859 0.41088 4.65549
360 1D7O TCL 0.0000001858 0.43548 4.7138
361 3OA2 NAD 0.000006302 0.48517 4.71698
362 1KOL NAD 0.00007369 0.46502 4.77387
363 1ZK4 AC0 0.000000001222 0.47429 4.78088
364 3ORF NAD 0.00003585 0.45956 4.78088
365 1ZK4 NAP 0.002293 0.40911 4.78088
366 3KB6 NAD 0.00003473 0.45512 4.79042
367 1NVM NAD 0.00004211 0.46473 4.80769
368 4ITU 1HS 0.0005279 0.44 4.83271
369 4ITU NAI 0.000293 0.43851 4.83271
370 4AP3 NAP 0.001492 0.43662 4.84171
371 3RFV NAI 0.0001045 0.4391 4.86891
372 1VL8 NAP 0.0004007 0.4278 4.86891
373 3RFV 15L 0.0006244 0.4067 4.86891
374 2GJN FMN 0.009383 0.40263 4.87805
375 4W6Z 8ID 0.0003373 0.44028 4.89914
376 3AD8 NAD 0.002382 0.40612 4.92611
377 3G5S FAD 0.003547 0.40313 4.96614
378 1MO9 FAD 0.005628 0.4232 4.97132
379 1MO9 KPC 0.005891 0.42292 4.97132
380 3B20 NAD 0.0005415 0.40357 5.01475
381 2F1K NAP 0.0001615 0.42843 5.01792
382 2I3G NAP 0.0007887 0.41852 5.02793
383 1UDB NAD 0.0002078 0.46385 5.02959
384 2Q1S NAI 0.00006535 0.47594 5.03979
385 4R1S NAP 0.0003778 0.4174 5.04451
386 1LGT BP3 0.00002296 0.41537 5.05051
387 1E3I CXF 0.0002389 0.42348 5.05319
388 1RPN NDP 0.001048 0.41671 5.07463
389 4PLG NAI 0.00001991 0.48775 5.08982
390 3CMC NAD 0.0008458 0.45021 5.08982
391 1P0F NAP 0.001665 0.40932 5.09383
392 2VT3 ATP 0.0000005117 0.44234 5.11628
393 3OND NAD 0.0001509 0.4663 5.12295
394 3QFA FAD 0.003068 0.41071 5.17241
395 1HYH NAD 0.000008747 0.48913 5.17799
396 2V6G NAP 0.0002385 0.43732 5.21415
397 3JV7 NAD 0.00006463 0.4681 5.21739
398 3WLE NAD 0.0003185 0.44122 5.27859
399 2AG5 NAD 0.0002617 0.43231 5.28455
400 1Q1R FAD 0.003859 0.40175 5.33643
401 1D1T NAD 0.0004053 0.4319 5.36193
402 1GUZ NAD 0.00001615 0.47193 5.48387
403 2NXE SAM 0.001757 0.44565 5.51181
404 2X6T NAP 0.0002656 0.43261 5.60224
405 3RO7 TDR 0.000003486 0.4196 5.66038
406 2NU8 COA 0.00004778 0.44688 5.6701
407 3G2O SAM 0.003674 0.43105 5.68562
408 1LSS NAD 0.0001607 0.40671 5.71429
409 2BLE 5GP 0.0000003879 0.41528 5.72207
410 1E1M NAP 0.006716 0.40605 5.77281
411 2RH4 EMO 0.001819 0.42234 5.77617
412 2B4R AES 0.0001431 0.44177 5.7971
413 2B4R NAD 0.0002167 0.43866 5.7971
414 3VPH OXM 0.00007139 0.46412 5.80645
415 3VPH NAD 0.0001111 0.45407 5.80645
416 4PVD NDP 0.0003688 0.41764 5.84795
417 1EBF NAD 0.000007346 0.46591 5.86592
418 3K9W 4PS 0.000007271 0.41336 5.88235
419 3K9W ADE 0.000007271 0.41336 5.88235
420 2DKN NAI 0.001463 0.40269 5.88235
421 3S9K CIT 0.03931 0.452 5.9322
422 3QVP FAD 0.002554 0.41474 5.95903
423 1YB5 NAP 0.0002579 0.44196 5.98291
424 1N7G NDP 0.0111 0.40652 6.03675
425 1B8U NAD 0.00001587 0.43967 6.07903
426 1B8U OAA 0.0002864 0.43744 6.07903
427 1SOW NAD 0.000009957 0.49109 6.09756
428 2VHW NAI 0.00001044 0.49678 6.1008
429 4TMK T5A 0.0000007045 0.44132 6.10329
430 2DC1 NAD 0.000009261 0.47472 6.14525
431 2BD0 NAP 0.0008935 0.41927 6.14754
432 3HVJ 705 0.003855 0.40176 6.33484
433 1EQ2 NAP 0.0002232 0.4351 6.45161
434 4A8T PAO 0.0000009366 0.41017 6.48968
435 1GQ2 NAP 0.0000119 0.47601 6.51769
436 3LZW NAP 0.001899 0.43092 6.51769
437 3LZW FAD 0.0007095 0.43061 6.51769
438 2GV8 FAD 0.001125 0.41821 6.51769
439 2GVC FAD 0.001109 0.41716 6.51769
440 1CF2 NAP 0.00009829 0.43808 6.52819
441 4O0L NDP 0.0003529 0.43112 6.54545
442 3GFB NAD 0.00003477 0.48601 6.57143
443 2B9W FAD 0.003784 0.41746 6.60377
444 2WET FAD 0.0009481 0.4292 6.65362
445 4NBT NAD 0.0004258 0.42172 6.66667
446 2GJ3 FAD 0.000009519 0.40036 6.66667
447 2FZW NAD 0.001847 0.42016 6.70241
448 2V3A FAD 0.002019 0.41346 6.70391
449 4Q3F TLA 0.0387 0.4003 6.83761
450 2PT9 2MH 0.002755 0.40377 6.85358
451 1V8B NAD 0.00008378 0.46293 6.88935
452 3TWO NDP 0.002586 0.40599 6.89655
453 1HDR NAD 0.0000533 0.48497 6.96721
454 4NBW NAD 0.00004748 0.45076 7.00389
455 1ZH8 NAP 0.000182 0.43181 7.05882
456 2JJQ SAH 0.01316 0.4158 7.05882
457 2DT5 NAD 0.000006758 0.48513 7.109
458 3SJ7 NDP 0.0007803 0.41262 7.14286
459 4MDH NAD 0.00001505 0.46831 7.18563
460 5MDH NAD 0.00001869 0.46529 7.20721
461 1HDG NAD 0.00004643 0.48914 7.22892
462 1RYI FAD 0.001914 0.41755 7.32984
463 4GLL NAD 0.001036 0.4169 7.4184
464 4TQG NDP 0.0003357 0.42602 7.43034
465 2HQM FAD 0.00211 0.41694 7.44879
466 2Q1W NAD 0.0003359 0.4349 7.50751
467 9LDB NAD 0.000009653 0.4876 7.53012
468 9LDT NAD 0.00001153 0.4848 7.53012
469 2GAG NAD 0.002509 0.40878 7.61905
470 2GAG FAD 0.005735 0.40302 7.61905
471 2GAG FOA 0.006846 0.40003 7.61905
472 1VQW FAD 0.001088 0.41746 7.65864
473 2I7C AAT 0.001012 0.41992 7.77385
474 2QRK AMP 0.0002956 0.44496 7.82123
475 1CER NAD 0.00005811 0.48114 7.85498
476 1PZG A3D 0.00009566 0.46213 7.85498
477 1J5P NAD 0.000001156 0.50639 7.90514
478 3B1J NAD 0.0001144 0.4449 8
479 1DLJ NAI 0.0009145 0.43767 8.00745
480 1DLJ UGA 0.002328 0.42177 8.00745
481 1NFQ NAI 0.0002075 0.44259 8.07692
482 2ZB4 5OP 0.004468 0.40042 8.12325
483 2ZB4 NAP 0.004185 0.40042 8.12325
484 4E5N NAD 0.00001371 0.48228 8.18182
485 1WDK NAD 0.00006252 0.43359 8.19367
486 3SJU NDP 0.002002 0.40887 8.24373
487 2B4Q NAP 0.001695 0.40397 8.33333
488 4BVA T3 0.001122 0.4231 8.35821
489 4BVA NDP 0.0009429 0.41572 8.35821
490 4NBU NAI 0.00005185 0.46105 8.4
491 1P3D UMA 0.0008717 0.40165 8.42105
492 1H5Q NAP 0.0009436 0.41563 8.67924
493 1GEE NAD 0.002329 0.40895 8.81226
494 1TV5 ORO 0.00006593 0.51431 8.93855
495 1TV5 N8E 0.0006732 0.46571 8.93855
496 1TV5 A26 0.001433 0.44133 8.93855
497 1TV5 FMN 0.0002297 0.41555 8.93855
498 1SJW NGV 0.0003496 0.42028 9.02778
499 2PR5 FMN 0.004993 0.43079 9.09091
500 2V3B FAD 0.002407 0.40946 9.09091
501 1Z45 NAD 0.0001415 0.44148 9.12477
502 3OFK SAH 0.009686 0.40276 9.25926
503 3GEG NAD 0.0001489 0.43385 9.31174
504 2YYY NAP 0.0006161 0.41761 9.32945
505 3UC5 ATP 0.000001215 0.4058 9.55414
506 1I0Z NAI 0.00004673 0.45931 9.60961
507 1VM6 NAD 0.0000148 0.45914 9.64912
508 3SHR CMP 0.01075 0.43561 9.699
509 3RJ5 NAD 0.003715 0.40345 10.2362
510 1GEG NAD 0.00015 0.44094 10.9375
511 3ZV6 4HB 0.0008733 0.43162 12.0996
512 3ZV6 NAD 0.000819 0.43162 12.0996
513 3KLJ FAD 0.0014 0.4134 12.2078
514 1BDB NAD 0.0003392 0.43041 12.2744
515 1LDM NAD 0.00007188 0.45308 12.462
516 1XSE NDP 0.003869 0.40486 12.8814
517 2Q46 NAP 0.0003018 0.42747 13.0435
518 1MXI SAH 0.004471 0.43272 13.125
519 2O07 MTA 0.001338 0.4009 13.1579
520 2O07 SPD 0.001999 0.40067 13.1579
521 3OJO NAD 0.000101 0.4259 14.3852
522 4J56 FAD 0.002836 0.41395 14.9123
523 3BAZ NAP 0.00002632 0.49916 15.3153
524 2CUL FAD 0.002756 0.40495 15.5172
525 2F5Z FAD 0.004776 0.40428 15.625
526 1O94 ADP 0.0005575 0.40386 17.4242
527 1UXG NAD 0.00002586 0.48489 17.7994
528 1RSD PSB 0.000243 0.40667 18.1818
529 3GX0 GDS 0.01461 0.40902 19.0698
530 3KPE TM3 0.003681 0.47867 20.5128
531 1NVV GNP 0.0000006549 0.40802 22.2892
532 1E6E FAD 0.002682 0.40656 22.6562
533 2EV9 NAP 0.0008597 0.41988 23.9544
534 1U1I NAD 0.00000000001328 0.71245 28.3163
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