Receptor
PDB id Resolution Class Description Source Keywords
4BRE 1.6 Å EC: 3.6.1.5 LEGIONELLA PNEUMOPHILA NTPDASE1 CRYSTAL FORM II (CLOSED) IN COMPLEX WITH TRANSITION STATE MIMIC ADENOSINE 5' PHOSPHOVAN LEGIONELLA PNEUMOPHILA HYDROLASE APYRASE ATPASE ADPASE CD39 PURINERGIC SIGNALLDOMAIN ROTATION TRANSITION STATE NTPDASE
Ref.: CRYSTALLOGRAPHIC SNAPSHOTS ALONG THE REACTION PATHW NUCLEOSIDE TRIPHOSPHATE DIPHOSPHOHYDROLASES STRUCTURE V. 21 1460 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:1397;
A:1397;
Invalid;
Invalid;
none;
none;
submit data
24.305 Mg [Mg+2...
NA A:1395;
Part of Protein;
none;
submit data
22.99 Na [Na+]
MES A:1398;
B:1397;
Invalid;
Invalid;
none;
none;
submit data
195.237 C6 H13 N O4 S C1COC...
50T B:1395;
A:1396;
Valid;
Valid;
none;
none;
submit data
465.184 C10 H17 N5 O11 P V c1nc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3AAQ 2 Å EC: 3.6.1.5 CRYSTAL STRUCTURE OF LP1NTPDASE FROM LEGIONELLA PNEUMOPHILA IN COMPLEX WITH THE INHIBITOR ARL 67156 LEGIONELLA PNEUMOPHILA ADENOSINE TRIPHOSPHATASE NTPDASE HYDROLASE
Ref.: CRYSTAL STRUCTURE OF A LEGIONELLA PNEUMOPHILA ECTO -TRIPHOSPHATE DIPHOSPHOHYDROLASE, A STRUCTURAL AND FUNCTIONAL HOMOLOG OF THE EUKARYOTIC NTPDASES STRUCTURE V. 18 228 2010
Members (15)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4BRA - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
2 4BR7 - AU1 C10 H16 N6 O9 P2 c1nc(c2c(n....
3 4BRI - UNP C9 H16 N3 O14 P3 C1=CN(C(=O....
4 4BRL - GMV C10 H17 N5 O12 P V c1nc2c(n1[....
5 4BRQ - AMP C10 H14 N5 O7 P c1nc(c2c(n....
6 4BRG - GMP C10 H13 N5 O5 c1nc2c(n1[....
7 4BRF - AMP C10 H14 N5 O7 P c1nc(c2c(n....
8 3AAQ Ki = 0.5 mM ARU C15 H24 Br2 N5 O12 P3 CCN(CC)c1c....
9 4BRH - TMV C12 H21 N4 O8 P S V Cc1c(sc[n+....
10 4BRN - AMP C10 H14 N5 O7 P c1nc(c2c(n....
11 4BRC - AU1 C10 H16 N6 O9 P2 c1nc(c2c(n....
12 4BRE - 50T C10 H17 N5 O11 P V c1nc(c2c(n....
13 4BRK - UNP C9 H16 N3 O14 P3 C1=CN(C(=O....
14 4BRD - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
15 3AAR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
70% Homology Family (15)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4BRA - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
2 4BR7 - AU1 C10 H16 N6 O9 P2 c1nc(c2c(n....
3 4BRI - UNP C9 H16 N3 O14 P3 C1=CN(C(=O....
4 4BRL - GMV C10 H17 N5 O12 P V c1nc2c(n1[....
5 4BRQ - AMP C10 H14 N5 O7 P c1nc(c2c(n....
6 4BRG - GMP C10 H13 N5 O5 c1nc2c(n1[....
7 4BRF - AMP C10 H14 N5 O7 P c1nc(c2c(n....
8 3AAQ Ki = 0.5 mM ARU C15 H24 Br2 N5 O12 P3 CCN(CC)c1c....
9 4BRH - TMV C12 H21 N4 O8 P S V Cc1c(sc[n+....
10 4BRN - AMP C10 H14 N5 O7 P c1nc(c2c(n....
11 4BRC - AU1 C10 H16 N6 O9 P2 c1nc(c2c(n....
12 4BRE - 50T C10 H17 N5 O11 P V c1nc(c2c(n....
13 4BRK - UNP C9 H16 N3 O14 P3 C1=CN(C(=O....
14 4BRD - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
15 3AAR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
50% Homology Family (15)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4BRA - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
2 4BR7 - AU1 C10 H16 N6 O9 P2 c1nc(c2c(n....
3 4BRI - UNP C9 H16 N3 O14 P3 C1=CN(C(=O....
4 4BRL - GMV C10 H17 N5 O12 P V c1nc2c(n1[....
5 4BRQ - AMP C10 H14 N5 O7 P c1nc(c2c(n....
6 4BRG - GMP C10 H13 N5 O5 c1nc2c(n1[....
7 4BRF - AMP C10 H14 N5 O7 P c1nc(c2c(n....
8 3AAQ Ki = 0.5 mM ARU C15 H24 Br2 N5 O12 P3 CCN(CC)c1c....
9 4BRH - TMV C12 H21 N4 O8 P S V Cc1c(sc[n+....
10 4BRN - AMP C10 H14 N5 O7 P c1nc(c2c(n....
11 4BRC - AU1 C10 H16 N6 O9 P2 c1nc(c2c(n....
12 4BRE - 50T C10 H17 N5 O11 P V c1nc(c2c(n....
13 4BRK - UNP C9 H16 N3 O14 P3 C1=CN(C(=O....
14 4BRD - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
15 3AAR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 50T; Similar ligands found: 328
No: Ligand ECFP6 Tc MDL keys Tc
1 50T 1 1
2 A2D 0.805556 0.931507
3 BA3 0.783784 0.931507
4 ADX 0.776316 0.839506
5 B4P 0.773333 0.931507
6 AP5 0.773333 0.931507
7 ADP 0.773333 0.958333
8 AMP 0.763889 0.957747
9 A 0.763889 0.957747
10 AN2 0.763158 0.945205
11 CA0 0.753247 0.906667
12 M33 0.753247 0.918919
13 SAP 0.746835 0.907895
14 AGS 0.746835 0.907895
15 ACP 0.74359 0.932432
16 ATP 0.74359 0.958333
17 APR 0.734177 0.931507
18 PRX 0.734177 0.881579
19 AR6 0.734177 0.931507
20 5FA 0.734177 0.958333
21 AQP 0.734177 0.958333
22 ABM 0.733333 0.905405
23 AD9 0.725 0.986111
24 AMP MG 0.72 0.905405
25 A12 0.714286 0.92
26 AP2 0.714286 0.92
27 ACQ 0.707317 0.932432
28 ANP 0.707317 0.932432
29 SRA 0.706667 0.906667
30 SRP 0.702381 0.87013
31 5AL 0.698795 0.893333
32 ATF 0.690476 0.92
33 AU1 0.6875 0.932432
34 5SV 0.678161 0.8375
35 APC 0.670732 0.92
36 4AD 0.670455 0.883117
37 ADP MG 0.666667 0.893333
38 TAT 0.666667 0.92
39 A22 0.666667 0.945205
40 ADP VO4 0.662791 0.945205
41 VO4 ADP 0.662791 0.945205
42 ADV 0.662651 0.894737
43 RBY 0.662651 0.894737
44 ADP PO3 0.662651 0.90411
45 25A 0.659091 0.931507
46 OOB 0.659091 0.893333
47 8QN 0.659091 0.893333
48 ADP BEF 0.658537 0.87013
49 BEF ADP 0.658537 0.87013
50 ATP MG 0.654762 0.893333
51 AMO 0.651685 0.894737
52 A1R 0.651685 0.871795
53 PAJ 0.651685 0.85
54 ADQ 0.651685 0.906667
55 GAP 0.647059 0.857143
56 00A 0.644444 0.848101
57 DLL 0.644444 0.893333
58 AHX 0.644444 0.860759
59 OAD 0.637363 0.906667
60 3UK 0.637363 0.881579
61 SON 0.634146 0.894737
62 PR8 0.630435 0.817073
63 LAD 0.630435 0.82716
64 WAQ 0.630435 0.848101
65 NB8 0.623656 0.860759
66 TXA 0.623656 0.894737
67 FYA 0.623656 0.893333
68 1ZZ 0.623656 0.807229
69 BIS 0.623656 0.896104
70 PTJ 0.623656 0.860759
71 3OD 0.623656 0.906667
72 ME8 0.623656 0.807229
73 25L 0.617021 0.945205
74 ADP ALF 0.613636 0.858974
75 ALF ADP 0.613636 0.858974
76 MAP 0.611111 0.933333
77 9SN 0.610526 0.8375
78 ANP MG 0.606742 0.883117
79 YAP 0.604167 0.858974
80 FA5 0.604167 0.87013
81 NAI 0.60396 0.871795
82 XAH 0.597938 0.807229
83 ADN 0.597222 0.833333
84 XYA 0.597222 0.833333
85 RAB 0.597222 0.833333
86 DAL AMP 0.593407 0.868421
87 AOC 0.592593 0.810811
88 4UV 0.591837 0.858974
89 NAX 0.588235 0.839506
90 G3A 0.585859 0.884615
91 5AS 0.583333 0.75
92 5N5 0.581081 0.808219
93 AFH 0.58 0.85
94 G5P 0.58 0.884615
95 4UU 0.58 0.858974
96 GTA 0.574257 0.851852
97 5CD 0.573333 0.794521
98 A4D 0.573333 0.808219
99 LAQ 0.568627 0.807229
100 ADP BMA 0.568421 0.881579
101 DTA 0.564103 0.776316
102 48N 0.563107 0.860759
103 YLP 0.563107 0.788235
104 A A 0.5625 0.931507
105 AP0 0.561905 0.860759
106 YLC 0.561905 0.807229
107 G5A 0.561798 0.75
108 BTX 0.559633 0.809524
109 NXX 0.557692 0.894737
110 6V0 0.557692 0.860759
111 DND 0.557692 0.894737
112 TXD 0.557692 0.871795
113 4UW 0.557692 0.82716
114 UP5 0.557692 0.883117
115 2A5 0.556818 0.881579
116 JB6 0.556701 0.848101
117 ATP A A A 0.555556 0.891892
118 A3P 0.552941 0.930556
119 TXE 0.552381 0.871795
120 OMR 0.552381 0.819277
121 TYM 0.552381 0.87013
122 EP4 0.551282 0.74359
123 MYR AMP 0.55102 0.785714
124 PAP 0.550562 0.944444
125 ATR 0.550562 0.930556
126 7D5 0.55 0.866667
127 PPS 0.549451 0.839506
128 YLB 0.54717 0.788235
129 4TC 0.54717 0.860759
130 UPA 0.54717 0.871795
131 ADJ 0.546296 0.819277
132 M2T 0.544304 0.725
133 3DH 0.54321 0.763158
134 A4P 0.542056 0.811765
135 7D3 0.541176 0.868421
136 BT5 0.540541 0.8
137 GMV 0.537634 0.909091
138 MTA 0.5375 0.763158
139 IOT 0.537037 0.8
140 3AM 0.536585 0.916667
141 A2P 0.534884 0.916667
142 TYR AMP 0.534653 0.846154
143 7D4 0.534091 0.868421
144 ITT 0.534091 0.90411
145 7MD 0.533981 0.829268
146 YLA 0.53211 0.788235
147 139 0.53211 0.839506
148 T5A 0.53211 0.809524
149 A2R 0.531915 0.945205
150 AMP DBH 0.529412 0.881579
151 TAD 0.528846 0.85
152 CNA 0.527273 0.894737
153 AYB 0.527273 0.77907
154 A5A 0.526882 0.776471
155 TSB 0.526316 0.788235
156 6RE 0.52381 0.75
157 SSA 0.521277 0.770115
158 AR6 AR6 0.519231 0.88
159 NAD 0.517857 0.893333
160 COD 0.517857 0.781609
161 52H 0.515789 0.75
162 VMS 0.515789 0.758621
163 54H 0.515789 0.758621
164 NSS 0.515464 0.770115
165 DSZ 0.515464 0.770115
166 ZAS 0.511905 0.75641
167 IMO 0.511628 0.890411
168 J7C 0.511628 0.759494
169 A3N 0.511628 0.776316
170 5X8 0.511111 0.753247
171 5CA 0.510417 0.770115
172 53H 0.510417 0.75
173 ARG AMP 0.509434 0.797619
174 AHZ 0.509434 0.785714
175 A3D 0.508772 0.881579
176 2AM 0.506024 0.930556
177 S4M 0.505747 0.659091
178 V3L 0.505376 0.931507
179 LPA AMP 0.504673 0.785714
180 DSH 0.5 0.716049
181 NAQ 0.5 0.8375
182 MAO 0.5 0.75
183 LSS 0.5 0.733333
184 P5A 0.5 0.717391
185 6AD 0.5 0.873418
186 N0B 0.495798 0.788235
187 M24 0.495726 0.817073
188 YLY 0.495726 0.77907
189 ALF ADP 3PG 0.495413 0.82716
190 AF3 ADP 3PG 0.495413 0.82716
191 LA8 ALF 3PG 0.495413 0.82716
192 NVA LMS 0.494949 0.733333
193 SAI 0.494624 0.746835
194 SFG 0.494505 0.74026
195 NAE 0.491525 0.858974
196 7MC 0.490909 0.809524
197 LEU LMS 0.49 0.733333
198 NA7 0.49 0.92
199 GJV 0.488636 0.740741
200 OVE 0.488372 0.893333
201 EAD 0.487603 0.839506
202 DZD 0.486957 0.85
203 5AD 0.486842 0.736111
204 KAA 0.485149 0.725275
205 GSU 0.485149 0.75
206 SA8 0.483871 0.698795
207 A5D 0.483871 0.776316
208 ZID 0.483333 0.881579
209 ARU 0.48 0.82716
210 GGZ 0.479592 0.792683
211 AV2 0.479167 0.931507
212 SAH 0.478723 0.734177
213 NAJ PZO 0.478632 0.814815
214 0WD 0.478261 0.884615
215 YSA 0.47619 0.75
216 AVV 0.474747 0.860759
217 3AT 0.473684 0.931507
218 6IA 0.473684 0.82716
219 A7D 0.472527 0.766234
220 NDE 0.472 0.894737
221 P1H 0.472 0.819277
222 NAD IBO 0.469565 0.835443
223 EEM 0.46875 0.702381
224 MHZ 0.467391 0.689655
225 71V 0.466667 0.896104
226 A3G 0.465909 0.789474
227 4TA 0.465517 0.776471
228 G A A A 0.465517 0.8375
229 NDP 0.464912 0.884615
230 NDC 0.464567 0.8375
231 6C6 0.463158 0.87013
232 Y3J 0.4625 0.716216
233 DAT 0.462366 0.868421
234 7D7 0.461538 0.733333
235 A6D 0.460784 0.714286
236 PO4 PO4 A A A A PO4 0.460784 0.864865
237 6K6 0.46 0.917808
238 GEK 0.46 0.707317
239 SMM 0.459184 0.678161
240 S7M 0.459184 0.682353
241 4YB 0.458716 0.733333
242 DTP 0.458333 0.868421
243 SAM 0.458333 0.682353
244 0UM 0.455446 0.690476
245 7C5 0.453704 0.78481
246 AAT 0.453608 0.698795
247 FB0 0.453125 0.775281
248 NPW 0.452174 0.851852
249 PGS 0.451613 0.848101
250 NAJ PYZ 0.45082 0.817073
251 DA 0.449438 0.866667
252 D5M 0.449438 0.866667
253 NEC 0.449438 0.736842
254 U A G G 0.449153 0.848101
255 2SA 0.44898 0.894737
256 NZQ 0.448276 0.873418
257 FAD 0.44697 0.819277
258 FAS 0.44697 0.819277
259 A A A 0.446602 0.868421
260 FDA 0.446154 0.802326
261 NJP 0.444444 0.907895
262 AAM 0.444444 0.957747
263 V1N 0.444444 0.905405
264 6FA 0.442748 0.809524
265 WSA 0.442478 0.758621
266 C2R 0.44186 0.866667
267 AMZ 0.44186 0.878378
268 A3S 0.44086 0.8
269 7DD 0.44086 0.944444
270 N6P 0.436893 0.902778
271 62X 0.436893 0.659091
272 SFD 0.43609 0.708333
273 AMP NAD 0.435484 0.846154
274 AIR 0.433735 0.888889
275 K15 0.432692 0.674419
276 ODP 0.432203 0.873418
277 Z5A 0.432 0.75
278 NIA 0.431818 0.790123
279 A3T 0.431579 0.810811
280 649 0.429825 0.717391
281 DDS 0.428571 0.842105
282 XNP 0.428571 0.839506
283 7DT 0.427083 0.944444
284 RGT 0.425926 0.92
285 TXP 0.423729 0.884615
286 62F 0.423358 0.829268
287 FNK 0.423358 0.775281
288 A U 0.422414 0.835443
289 APU 0.422414 0.858974
290 101 0.422222 0.866667
291 3AD 0.421687 0.794521
292 KB1 0.420561 0.690476
293 FAY 0.42029 0.829268
294 P5F 0.41958 0.793103
295 NAD BBN 0.419118 0.831325
296 7RP 0.417582 0.915493
297 S8M 0.417476 0.75
298 RFL 0.417266 0.790698
299 NMN AMP PO4 0.416667 0.835443
300 AS 0.413043 0.822785
301 7RA 0.413043 0.944444
302 FAI 0.413043 0.878378
303 SXZ 0.411215 0.682353
304 QQY 0.411111 0.805195
305 ACK 0.411111 0.849315
306 RP1 0.411111 0.831169
307 SP1 0.411111 0.831169
308 PLP AAD 0.409836 0.733333
309 128 0.408696 0.747126
310 8BR 0.408602 0.894737
311 NVA 2AD 0.408163 0.734177
312 TM1 0.407407 0.744186
313 CC5 0.407407 0.805556
314 CMP 0.404255 0.888889
315 2BA 0.404255 0.876712
316 F2N 0.40411 0.784091
317 GP3 0.40404 0.884615
318 12D 0.403509 0.755814
319 DCA 0.403226 0.793103
320 ETB 0.403226 0.802326
321 NAD CJ3 0.402878 0.802326
322 2VA 0.402062 0.789474
323 NAP 0.401575 0.906667
324 26A 0.4 0.753247
325 ZZB 0.4 0.785714
326 GDP 0.4 0.883117
327 QQX 0.4 0.794872
328 PUA 0.4 0.85
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3AAQ; Ligand: ARU; Similar sites found: 85
This union binding pocket(no: 1) in the query (biounit: 3aaq.bio1) has 37 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4CP8 MLI 0.02755 0.42066 1.13314
2 5SXS NIZ 0.02681 0.42187 1.69972
3 5MPQ BLG 0.02904 0.40649 1.69972
4 2BUP ATP 0.0004781 0.46049 1.983
5 2BUP ADP 0.0004781 0.46049 1.983
6 4MO4 ACP 0.00231 0.4021 1.983
7 4WZ6 ATP 0.03512 0.41495 2.06897
8 3EXS 5RP 0.03729 0.40436 2.26244
9 5HTX ADP 0.0294 0.40976 2.26629
10 1RYO OXL 0.04491 0.4044 2.44648
11 4BGB ADP 0.0323 0.40763 2.46154
12 2QXL ATP 0.0007258 0.4642 2.54958
13 5LY3 ADP 0.009255 0.41724 2.54958
14 2AWN ADP 0.02804 0.41441 2.54958
15 2V7Y ADP 0.01725 0.40775 2.54958
16 4CZG ADP 0.0004296 0.43082 2.58621
17 4CZG QH3 0.0005778 0.42356 2.58621
18 1NW4 IMH 0.01033 0.4377 2.89855
19 5DG2 GAL GLC 0.02322 0.40786 2.96296
20 2Y6P CTP 0.02182 0.41651 2.99145
21 2YMZ LAT 0.01911 0.4142 3.07692
22 5EOU ATP 0.00005004 0.41243 3.11615
23 3NHB ADP 0.02266 0.42553 3.26797
24 5F1X ATP 0.0001057 0.46577 3.39943
25 3TDC 0EU 0.004103 0.43016 3.39943
26 3IT6 ORN 0.03309 0.41692 3.51759
27 3WQT ANP 0.00007233 0.4095 3.68272
28 3VSV XYP 0.0492 0.40153 3.68272
29 1G55 SAH 0.009202 0.41417 3.79009
30 4CBU ATP 0.0008855 0.44558 3.93701
31 4CBX ATP 0.00336 0.43404 3.96601
32 1K0E TRP 0.03854 0.4002 3.96601
33 2E2P ADP 0.008864 0.42869 4.01338
34 3BFV ADP 0.04213 0.40158 4.05904
35 2EB5 OXL 0.03978 0.40889 4.11985
36 2YCH ATP 0.0002299 0.47816 4.24929
37 4B1W ATP 0.000593 0.46022 4.24929
38 4PKG ATP 0.00497 0.42633 4.24929
39 4PL8 ATP 0.005102 0.42581 4.24929
40 3U9Z ADP 0.007263 0.42555 4.24929
41 4B1V ATP 0.004586 0.42462 4.24929
42 2FF6 ATP 0.005739 0.42349 4.24929
43 4B1X ATP 0.005003 0.42293 4.24929
44 1T44 ATP 0.005983 0.42267 4.24929
45 1SQK ADP 0.01609 0.41245 4.24929
46 3WXL ADP 0.0001811 0.54731 4.53258
47 4A2A ATP 0.0009923 0.45805 4.53258
48 4PKI ATP 0.0122 0.4086 4.62963
49 4B9Q ATP 0.003179 0.4317 4.81586
50 1KXP ATP 0.005401 0.42469 5.09915
51 1J78 OLA 0.006992 0.41364 5.09915
52 1A78 TDG 0.04459 0.41036 5.22388
53 3P7G MAN 0.0327 0.41691 5.47945
54 1C1L GAL BGC 0.0428 0.4089 5.83942
55 2VWA PTY 0.02464 0.41778 5.94059
56 3CTL S6P 0.01291 0.40748 6.06061
57 5TH5 MET 0.04064 0.40985 6.08365
58 3LDQ 3P1 0.008292 0.41623 6.14035
59 3SAO DBH 0.04192 0.41791 6.25
60 3WMX THR 0.011 0.45021 6.51558
61 3MN6 ATP 0.0008914 0.45625 6.79887
62 3MN7 ATP 0.001366 0.44441 6.79887
63 3MN9 ATP 0.004934 0.42647 6.79887
64 3U4L ATP 0.001015 0.45375 7.85714
65 2PAV ATP 0.003455 0.40722 7.91367
66 3NOJ PYR 0.01345 0.43282 7.98319
67 2D0O ADP 0.01132 0.42344 8.2153
68 3B5J 12D 0.02616 0.42035 8.64198
69 2UYT ADP 0.004809 0.40167 8.78187
70 2UYT LRH 0.004809 0.40167 8.78187
71 2VOH CIT 0.03203 0.40319 10.1911
72 2D1K ATP 0.003689 0.4322 10.3846
73 2A3Z ATP 0.005436 0.42456 10.3846
74 1YRO UDP 0.004097 0.47557 11.3821
75 2PBD ATP 0.005696 0.42364 11.6279
76 2QWO ADP 0.001249 0.44263 11.9565
77 3VY6 BGC BGC 0.04798 0.4039 12.0567
78 4EHU ANP 0.00009551 0.49044 12.6812
79 4A59 AMP 0.0000001448 0.63172 13.5977
80 2A40 ATP 0.005074 0.42592 21.875
81 2V51 ATP 0.005318 0.42175 21.875
82 4B1Y ATP 0.004736 0.42085 21.875
83 2ZGY GDP 0.00051 0.47545 23.125
84 4A62 ANP 0.001816 0.43902 23.125
85 1SN0 T44 0.03467 0.40256 24.6154
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