Receptor
PDB id Resolution Class Description Source Keywords
4O1G 1.5 Å EC: 2.7.1.20 MTB ADENOSINE KINASE IN COMPLEX WITH GAMMA-THIO-ATP MYCOBACTERIUM TUBERCULOSIS ADENOSINE KINASE TRANSFERASE
Ref.: STRUCTURAL BASIS FOR INHIBITION OF MYCOBACTERIAL AN ADENOSINE KINASE BY 7-SUBSTITUTED 7-(HET)ARYL-7-DEA RIBONUCLEOSIDES J.MED.CHEM. V. 57 8268 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
AGS A:402;
Valid;
none;
submit data
523.247 C10 H16 N5 O12 P3 S c1nc(...
NA A:401;
Part of Protein;
none;
submit data
22.99 Na [Na+]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4PVV 2.5 Å EC: 2.7.1.20 MICOBACTERIAL ADENOSINE KINASE IN COMPLEX WITH INHIBITOR MYCOBACTERIUM TUBERCULOSIS ADENOSINE KINASE TRANSFERASE-TRANSFERASE INHIBITOR COMPLEX
Ref.: STRUCTURAL BASIS FOR INHIBITION OF MYCOBACTERIAL AN ADENOSINE KINASE BY 7-SUBSTITUTED 7-(HET)ARYL-7-DEA RIBONUCLEOSIDES J.MED.CHEM. V. 57 8268 2014
Members (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 6 families.
1 4PVV ic50 = 0.33 uM HO4 C13 H14 N4 O4 C#Cc1cn(c2....
2 4O1G - AGS C10 H16 N5 O12 P3 S c1nc(c2c(n....
3 2PKK - 2FA C10 H12 F N5 O4 c1nc2c(nc(....
4 2PKM - ADN C10 H13 N5 O4 c1nc(c2c(n....
5 2PKN - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
70% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 6 families.
1 4PVV ic50 = 0.33 uM HO4 C13 H14 N4 O4 C#Cc1cn(c2....
2 4O1G - AGS C10 H16 N5 O12 P3 S c1nc(c2c(n....
3 2PKK - 2FA C10 H12 F N5 O4 c1nc2c(nc(....
4 2PKM - ADN C10 H13 N5 O4 c1nc(c2c(n....
5 2PKN - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
50% Homology Family (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4PVV ic50 = 0.33 uM HO4 C13 H14 N4 O4 C#Cc1cn(c2....
2 4O1G - AGS C10 H16 N5 O12 P3 S c1nc(c2c(n....
3 2PKK - 2FA C10 H12 F N5 O4 c1nc2c(nc(....
4 2PKM - ADN C10 H13 N5 O4 c1nc(c2c(n....
5 2PKN - ACP C11 H18 N5 O12 P3 c1nc(c2c(n....
6 3B1P - NOS C10 H12 N4 O5 c1nc2c(n1[....
7 3B1Q - NOS C10 H12 N4 O5 c1nc2c(n1[....
8 3B1R - AMP MG n/a n/a
9 3B1N - MZR C9 H13 N3 O6 c1nc(c(n1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: AGS; Similar ligands found: 407
No: Ligand ECFP6 Tc MDL keys Tc
1 AGS 1 1
2 SAP 1 1
3 BA3 0.887324 0.92
4 B4P 0.875 0.92
5 AP5 0.875 0.92
6 A2D 0.859155 0.92
7 ATP 0.84 0.945946
8 AQP 0.828947 0.945946
9 5FA 0.828947 0.945946
10 AN2 0.813333 0.933333
11 ADP 0.8 0.945946
12 APR 0.782051 0.92
13 AR6 0.782051 0.92
14 M33 0.779221 0.907895
15 AD9 0.772152 0.921053
16 ACP 0.769231 0.921053
17 SRA 0.756757 0.972973
18 A22 0.75 0.933333
19 50T 0.746835 0.907895
20 AMP 0.743243 0.918919
21 A 0.743243 0.918919
22 ADX 0.734177 0.9
23 CA0 0.734177 0.896104
24 ADQ 0.732558 0.896104
25 ACQ 0.731707 0.921053
26 ANP 0.731707 0.921053
27 25L 0.730337 0.933333
28 PRX 0.716049 0.848101
29 OAD 0.715909 0.896104
30 ATF 0.714286 0.909091
31 ABM 0.714286 0.87013
32 AMP MG 0.701299 0.846154
33 A12 0.696203 0.909091
34 AP2 0.696203 0.909091
35 A1R 0.693182 0.8625
36 TAT 0.690476 0.986486
37 5AL 0.682353 0.883117
38 25A 0.681818 0.92
39 3OD 0.681319 0.896104
40 APC 0.674699 0.909091
41 AU1 0.670732 0.921053
42 ADP MG 0.670732 0.858974
43 SRP 0.666667 0.860759
44 BEF ADP 0.662651 0.8375
45 ADP BEF 0.662651 0.8375
46 G3A 0.65625 0.875
47 4AD 0.655556 0.873418
48 AFH 0.649485 0.841463
49 G5P 0.649485 0.875
50 00A 0.648352 0.839506
51 ADV 0.647059 0.884615
52 ADP PO3 0.647059 0.893333
53 RBY 0.647059 0.884615
54 BIS 0.645161 0.886076
55 OOB 0.644444 0.883117
56 5SV 0.644444 0.807229
57 8QN 0.644444 0.883117
58 GTA 0.642857 0.843373
59 ATP MG 0.639535 0.858974
60 PAJ 0.637363 0.841463
61 AMO 0.637363 0.884615
62 ITT 0.630952 0.893333
63 AHX 0.630435 0.851852
64 DLL 0.630435 0.883117
65 VO4 ADP 0.629214 0.883117
66 ADP VO4 0.629214 0.883117
67 NB8 0.62766 0.851852
68 UP5 0.623762 0.873418
69 3UK 0.623656 0.871795
70 SON 0.619048 0.884615
71 ALF ADP 0.617977 0.82716
72 ADP ALF 0.617977 0.82716
73 OMR 0.617647 0.811765
74 LAD 0.617021 0.819277
75 WAQ 0.617021 0.839506
76 PR8 0.617021 0.809524
77 MAP 0.615385 0.897436
78 GAP 0.613636 0.848101
79 7D4 0.611765 0.858974
80 ANP MG 0.611111 0.85
81 FYA 0.610526 0.858974
82 1ZZ 0.610526 0.8
83 ME8 0.610526 0.821429
84 TXA 0.610526 0.884615
85 PTJ 0.610526 0.851852
86 ATR 0.609195 0.918919
87 PAP 0.609195 0.932432
88 NAX 0.607843 0.831325
89 6V0 0.607843 0.851852
90 NAI 0.607843 0.8625
91 ADP BMA 0.606383 0.871795
92 A4P 0.605769 0.804598
93 A2R 0.604396 0.933333
94 XYA 0.60274 0.8
95 ADN 0.60274 0.8
96 RAB 0.60274 0.8
97 48N 0.598039 0.851852
98 9SN 0.597938 0.829268
99 139 0.59434 0.831325
100 T5A 0.59434 0.802326
101 NXX 0.592233 0.884615
102 DND 0.592233 0.884615
103 TXD 0.592233 0.8625
104 YAP 0.591837 0.85
105 FA5 0.591837 0.860759
106 TXE 0.586538 0.8625
107 XAH 0.585859 0.8
108 A A 0.583333 0.894737
109 AP0 0.580952 0.851852
110 DAL AMP 0.580645 0.858974
111 4UV 0.58 0.85
112 2A5 0.579545 0.871795
113 AOC 0.578313 0.779221
114 COD 0.577982 0.795455
115 A3P 0.576471 0.918919
116 ATP A A A 0.575758 0.881579
117 CNA 0.574074 0.884615
118 LAQ 0.572816 0.865854
119 5AS 0.569767 0.804598
120 4UU 0.568627 0.85
121 YLP 0.567308 0.781609
122 UPA 0.566038 0.8625
123 4TC 0.566038 0.851852
124 YLB 0.566038 0.781609
125 5N5 0.565789 0.776316
126 ADJ 0.564815 0.811765
127 7D3 0.564706 0.858974
128 3AM 0.560976 0.88
129 A4D 0.558442 0.8
130 5CD 0.558442 0.763158
131 A2P 0.55814 0.905405
132 NA7 0.556701 0.909091
133 PPS 0.554348 0.9
134 G5A 0.549451 0.804598
135 GSP 0.547368 0.924051
136 4UW 0.54717 0.819277
137 JB6 0.545455 0.910256
138 3AT 0.543478 0.92
139 TYM 0.542056 0.860759
140 MYR AMP 0.54 0.77907
141 AR6 AR6 0.538462 0.87013
142 EP4 0.5375 0.716049
143 YLC 0.537037 0.8
144 7D5 0.536585 0.833333
145 NAD 0.535714 0.883117
146 M2T 0.530864 0.719512
147 DTA 0.530864 0.792208
148 3DH 0.53012 0.75641
149 2AM 0.53012 0.893333
150 AHZ 0.528302 0.821429
151 IOT 0.527273 0.793103
152 DTP 0.526882 0.858974
153 A3D 0.526316 0.871795
154 SSA 0.526316 0.825581
155 MTA 0.52439 0.75641
156 TYR AMP 0.524272 0.8375
157 YLA 0.522523 0.781609
158 BTX 0.522124 0.845238
159 6AD 0.521277 0.911392
160 AMP DBH 0.519231 0.848101
161 TAD 0.518868 0.8875
162 AYB 0.517857 0.772727
163 BT5 0.517544 0.835294
164 A5A 0.515789 0.833333
165 TSB 0.515464 0.845238
166 6RE 0.511628 0.722892
167 OVE 0.511628 0.933333
168 7DT 0.51087 0.932432
169 V3L 0.510638 0.92
170 AVV 0.510204 0.851852
171 7MD 0.509434 0.821429
172 LPA AMP 0.509259 0.843373
173 0WD 0.508772 0.875
174 NAE 0.508475 0.85
175 VMS 0.505155 0.813953
176 54H 0.505155 0.813953
177 52H 0.505155 0.804598
178 NSS 0.50505 0.825581
179 NAQ 0.504202 0.829268
180 EAD 0.504132 0.831325
181 FB0 0.504 0.769231
182 ZAS 0.5 0.728395
183 ARG AMP 0.5 0.790698
184 53H 0.5 0.804598
185 IMO 0.5 0.88
186 RGT 0.5 0.909091
187 AF3 ADP 3PG 0.5 0.797619
188 ARU 0.5 0.819277
189 ALF ADP 3PG 0.5 0.797619
190 LA8 ALF 3PG 0.5 0.797619
191 J7C 0.5 0.731707
192 5CA 0.5 0.825581
193 AV2 0.5 0.87013
194 NJP 0.5 0.897436
195 ZID 0.5 0.871795
196 A3N 0.5 0.746835
197 M24 0.5 0.809524
198 NPW 0.495575 0.843373
199 NDP 0.495575 0.875
200 DDS 0.494737 0.833333
201 S4M 0.494382 0.655556
202 6FA 0.492188 0.802326
203 DZD 0.491379 0.841463
204 NZQ 0.491228 0.864198
205 P5A 0.490196 0.769231
206 DSZ 0.49 0.825581
207 LSS 0.49 0.786517
208 MAO 0.488889 0.724138
209 DSH 0.488636 0.710843
210 P1H 0.488 0.811765
211 N0B 0.487603 0.781609
212 YLY 0.487395 0.772727
213 ODP 0.486957 0.864198
214 NVA LMS 0.485149 0.786517
215 FAS 0.484615 0.811765
216 SFD 0.484615 0.776596
217 FAD 0.484615 0.811765
218 FDA 0.484375 0.795455
219 5X8 0.483871 0.746835
220 DAT 0.483871 0.858974
221 NAJ PZO 0.483051 0.807229
222 G A A A 0.482759 0.829268
223 7MC 0.482143 0.802326
224 62F 0.481203 0.821429
225 PO4 PO4 A A A A PO4 0.480392 0.855263
226 LEU LMS 0.480392 0.786517
227 TXP 0.478261 0.875
228 7DD 0.478261 0.932432
229 GJV 0.477778 0.714286
230 NDE 0.47619 0.884615
231 GSU 0.475728 0.804598
232 KAA 0.475728 0.777778
233 5AD 0.474359 0.706667
234 NAD IBO 0.474138 0.82716
235 A3G 0.47191 0.759494
236 XNP 0.470085 0.831325
237 4TA 0.470085 0.770115
238 6C6 0.46875 0.8375
239 GP3 0.46875 0.875
240 NDC 0.46875 0.829268
241 7D7 0.468354 0.705128
242 SFG 0.468085 0.7125
243 YSA 0.46729 0.804598
244 FAY 0.466667 0.821429
245 DCA 0.466667 0.786517
246 ETB 0.466667 0.795455
247 U A G G 0.466102 0.839506
248 A A A 0.466019 0.858974
249 128 0.464286 0.741573
250 RFL 0.463235 0.784091
251 PUA 0.46281 0.841463
252 A7D 0.462366 0.759494
253 FNK 0.459259 0.769231
254 COA 0.459016 0.806818
255 0T1 0.459016 0.786517
256 7C5 0.458716 0.777778
257 A5D 0.458333 0.792208
258 SA8 0.458333 0.674419
259 MHZ 0.457447 0.666667
260 71V 0.456522 0.910256
261 NEC 0.455556 0.708861
262 GGZ 0.455446 0.851852
263 NAJ PYZ 0.455285 0.809524
264 SAI 0.453608 0.698795
265 SAH 0.453608 0.728395
266 Y3J 0.451219 0.688312
267 GEK 0.45098 0.722892
268 AS 0.450549 0.884615
269 4YB 0.45045 0.786517
270 SMM 0.45 0.674157
271 GTP 0.45 0.873418
272 SAM 0.44898 0.678161
273 6IA 0.44898 0.797619
274 TAP 0.448 0.935065
275 CAO 0.448 0.8
276 COS 0.448 0.808989
277 30N 0.448 0.776596
278 AMX 0.448 0.795455
279 AAT 0.444444 0.714286
280 CMX 0.444444 0.786517
281 SCO 0.444444 0.786517
282 EEM 0.444444 0.659091
283 P5F 0.443662 0.786517
284 PGS 0.442105 0.910256
285 FCX 0.440945 0.76087
286 ACO 0.440945 0.8
287 FAM 0.440945 0.769231
288 2SA 0.44 0.884615
289 AMP NAD 0.44 0.8375
290 NAP 0.44 0.896104
291 A U 0.439655 0.82716
292 APU 0.439655 0.85
293 D5M 0.43956 0.833333
294 DA 0.43956 0.833333
295 HAX 0.4375 0.769231
296 1DG 0.436508 0.875
297 Z5A 0.436508 0.744444
298 DG1 0.436508 0.875
299 V1N 0.436364 0.87013
300 S7M 0.435644 0.678161
301 2MC 0.435115 0.774194
302 WSA 0.434783 0.813953
303 AAM 0.434783 0.918919
304 649 0.434783 0.769231
305 3KK 0.434109 0.808989
306 FYN 0.434109 0.806818
307 NMN AMP PO4 0.433333 0.82716
308 NA0 0.433071 0.884615
309 C2R 0.431818 0.857143
310 AMZ 0.431818 0.868421
311 A3S 0.431579 0.769231
312 COK 0.430769 0.808989
313 OXK 0.430769 0.808989
314 SOP 0.430769 0.788889
315 MCD 0.430769 0.769231
316 CA6 0.430769 0.752577
317 GNH 0.43 0.8625
318 101 0.428571 0.833333
319 62X 0.428571 0.637363
320 N6P 0.428571 0.866667
321 F2N 0.427586 0.777778
322 NMX 0.427481 0.729167
323 CMC 0.427481 0.788889
324 1VU 0.427481 0.8
325 CO6 0.427481 0.808989
326 GDD 0.427273 0.841463
327 GKE 0.427273 0.841463
328 GDC 0.427273 0.841463
329 SCA 0.425373 0.808989
330 FA9 0.424658 0.823529
331 A6D 0.424528 0.729412
332 K15 0.424528 0.651685
333 SCD 0.424242 0.786517
334 CAJ 0.424242 0.769231
335 AIR 0.423529 0.853333
336 6K6 0.423077 0.881579
337 A3T 0.42268 0.779221
338 NIA 0.422222 0.783133
339 NHD 0.421488 0.858974
340 12D 0.421053 0.75
341 IVC 0.421053 0.818182
342 A1S 0.421053 0.788889
343 BCO 0.421053 0.808989
344 1HE 0.421053 0.791209
345 3HC 0.421053 0.818182
346 MLC 0.421053 0.808989
347 1CZ 0.42029 0.820225
348 GDP 0.42 0.873418
349 0UM 0.419048 0.666667
350 COO 0.41791 0.808989
351 YE1 0.41791 0.777778
352 MCA 0.41791 0.8
353 CAA 0.41791 0.818182
354 G1R 0.417476 0.8625
355 GCP 0.417476 0.851852
356 NAD CJ3 0.417266 0.837209
357 SXZ 0.416667 0.697674
358 MC4 0.414815 0.765957
359 2CP 0.414815 0.78022
360 PLP AAD 0.414634 0.728261
361 NVA 2AD 0.414141 0.707317
362 ZDA 0.414141 0.820513
363 NAD BBN 0.413043 0.802326
364 KB1 0.412844 0.666667
365 HGG 0.411765 0.808989
366 CA8 0.411765 0.770833
367 COF 0.411765 0.771739
368 BYC 0.411765 0.808989
369 COW 0.411765 0.8
370 U G A 0.411765 0.8
371 MGP 0.411765 0.841463
372 2KQ 0.411765 0.791209
373 3AD 0.411765 0.763158
374 3CP 0.411765 0.788889
375 IRC 0.411765 0.818182
376 1GZ 0.411765 0.8
377 N01 0.41129 0.858974
378 S8M 0.409524 0.743902
379 FAQ 0.408759 0.808989
380 4CA 0.408759 0.78022
381 BCA 0.408759 0.8
382 7RP 0.408602 0.878378
383 2VA 0.408163 0.759494
384 6G0 0.407767 0.841463
385 CO7 0.407407 0.808989
386 26A 0.406977 0.725
387 QQX 0.406593 0.857143
388 GRA 0.405797 0.808989
389 HXC 0.405797 0.791209
390 7RA 0.404255 0.906667
391 FAI 0.404255 0.868421
392 GPG 0.40367 0.864198
393 TGC 0.402878 0.8
394 RP1 0.402174 0.894737
395 QQY 0.402174 0.844156
396 SP1 0.402174 0.894737
397 ACK 0.402174 0.815789
398 TM1 0.4 0.738636
399 CO8 0.4 0.791209
400 CIC 0.4 0.788889
401 U A C C 0.4 0.817073
402 8BR 0.4 0.860759
403 S0N 0.4 0.769231
404 GNP 0.4 0.851852
405 APC G U 0.4 0.795181
406 2NE 0.4 0.791209
407 SLU 0.4 0.816092
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4PVV; Ligand: HO4; Similar sites found: 154
This union binding pocket(no: 1) in the query (biounit: 4pvv.bio1) has 40 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO5 PIH 0.0003735 0.55571 None
2 3S9K CIT 0.001859 0.51641 None
3 1LNX URI 0.0151 0.4384 None
4 3KPE TM3 0.03434 0.40997 None
5 4OAS 2SW 0.03235 0.40271 None
6 3KMT SAH 0.0152 0.40113 None
7 2WA4 069 0.001352 0.44816 0.925926
8 3NFZ 3NF 0.001449 0.44692 1.54321
9 2R42 FPS 0.01107 0.41257 1.54321
10 4FWE FAD 0.0001036 0.41211 1.54321
11 1G8S MET 0.004282 0.45358 1.73913
12 4JWX 1N4 0.008925 0.42768 1.78571
13 2Z9V PXM 0.002026 0.45666 1.85185
14 2F2U M77 0.002464 0.44224 1.85185
15 1K0E TRP 0.04188 0.40023 1.85185
16 3SHR CMP 0.002971 0.43879 2.00669
17 1Y9Q MED 0.01222 0.43169 2.08333
18 3QV9 QV7 0.006472 0.43926 2.16049
19 1H82 FAD 0.0003492 0.40998 2.16049
20 2Z1U ATP 0.01129 0.40273 2.16049
21 2BH9 NAP 0.01188 0.40187 2.16049
22 2YVF FAD 0.0009437 0.4006 2.16049
23 3F81 STT 0.001844 0.49468 2.18579
24 1GS5 NLG 0.00005492 0.40488 2.32558
25 1GS5 ANP 0.00005492 0.40488 2.32558
26 3F8C HT1 0.007285 0.43687 2.38095
27 2NCD ADP 0.01125 0.42808 2.46914
28 3PLN U5P 0.01203 0.42183 2.46914
29 2DPY ADP 0.03639 0.41438 2.46914
30 2YP9 SIA CMO 0.009405 0.40407 2.46914
31 1A8S PPI 0.00605 0.42349 2.5641
32 2ORV 4TA 0.001238 0.41352 2.5641
33 3OCZ SRA 0.007164 0.40686 2.67176
34 1Y42 TYR 0.001806 0.45892 2.77778
35 4E28 0MZ 0.004218 0.4479 2.77778
36 4E28 9MZ 0.008649 0.43892 2.77778
37 2IYF UDP 0.03294 0.4128 2.77778
38 1WD4 AHR 0.0366 0.41033 2.77778
39 4E3Q PMP 0.03783 0.40592 2.77778
40 1YBQ BDH 0.03021 0.40421 2.77778
41 2NUN ADP 0.046 0.40496 2.78638
42 1T26 NAI 0.003502 0.40071 2.79503
43 1T26 GBD 0.003502 0.40071 2.79503
44 2BES RES 0.01218 0.40879 2.90698
45 3MAG 3MA 0.0241 0.44185 2.9316
46 3MAG SAH 0.000942 0.43205 2.9316
47 2PR5 FMN 0.006297 0.4055 3.0303
48 4K30 NLG 0.01373 0.41924 3.125
49 2QTR NXX 0.0004224 0.40934 3.1746
50 1M9H NAD 0.0008888 0.40865 3.23741
51 1Z44 NPO 0.007506 0.47964 3.39506
52 2XDQ MGX 0.004767 0.4726 3.39506
53 1Z44 FMN 0.01195 0.40535 3.39506
54 3B6C SDN 0.01986 0.42886 3.4188
55 3LTW HLZ 0.01383 0.42909 3.57143
56 1V6A TRE 0.006009 0.44076 3.61446
57 4C5N PXL 0.00006221 0.46721 3.62319
58 4C5N ACP 0.00007713 0.46698 3.62319
59 1UF5 CDT 0.01515 0.40874 3.63036
60 2Y7P SAL 0.005076 0.43873 3.66972
61 1O9U ADZ 0.001357 0.5018 3.7037
62 1I0Z OXM 0.006079 0.46694 3.7037
63 1V5F FAD 0.0009603 0.43387 3.7037
64 1V5F TPP 0.0009603 0.43387 3.7037
65 2WPW ACO 0.02824 0.40249 3.7037
66 1DBT U5P 0.006375 0.4053 3.76569
67 1ULE GLA GAL NAG 0.01077 0.44654 4
68 2Q8H TF4 0.03778 0.42416 4.01235
69 1QO0 BMD 0.02157 0.41978 4.01235
70 1PEA ACM 0.0366 0.41894 4.01235
71 4DYO SD4 0.01256 0.41644 4.01235
72 3HB5 E2B 0.001501 0.41077 4.01235
73 4ASJ N6A 0.002093 0.40918 4.09556
74 1MZV AMP 0.004831 0.42984 4.25532
75 1Q11 TYE 0.007305 0.43161 4.32099
76 4P4T GDP 0.006365 0.40533 4.32099
77 4HA6 FAD 0.0002782 0.40105 4.32099
78 1MXI SAH 0.0006536 0.44201 4.375
79 4XF6 INS 0.009019 0.41219 4.3956
80 4XF6 LIP 0.009019 0.41219 4.3956
81 4XF6 ADP 0.01174 0.40384 4.3956
82 2XVE FAD 0.0008967 0.40197 4.93827
83 1HPG BOC ALA ALA PRO GLU 0.03949 0.40155 4.93827
84 3PMA SCR 0.007325 0.44682 5.01931
85 1TDF NAP 0.001084 0.4053 5.6962
86 2Z9I GLY ALA THR VAL 0.02259 0.42831 5.8642
87 1OYB FMN 0.0006041 0.42737 5.8642
88 1RZM PEP 0.01339 0.41973 5.8642
89 1K97 ASP 0.0009565 0.41185 5.8642
90 1K97 CIR 0.0009565 0.41185 5.8642
91 1RZM E4P 0.04779 0.40768 5.8642
92 2QV7 ADP 0.02544 0.40471 5.8642
93 1OYB HBA 0.001571 0.40395 5.8642
94 1F1V DHY 0.02471 0.40353 5.88235
95 3RF4 FUN 0.001414 0.46368 6.03448
96 3ZV6 4HB 0.00008153 0.41361 6.04982
97 3ZV6 NAD 0.00007565 0.41324 6.04982
98 3ZPG 5GP 0.002202 0.49056 6.17284
99 3I8P 840 0.005261 0.41572 6.48148
100 3A1I UNU 0.01591 0.40784 6.48148
101 2VAR ANP 0.0000015 0.44619 6.70927
102 1I2B USQ 0.0004458 0.40539 6.79012
103 1I2B UPG 0.0004458 0.40539 6.79012
104 1I2B NAD 0.0004458 0.40539 6.79012
105 4DZ1 DAL 0.03009 0.42091 6.94981
106 2OAT PFM 0.01008 0.4012 7.09877
107 1C1L GAL BGC 0.02752 0.41979 7.29927
108 2QLX RM4 0.02756 0.41975 7.40741
109 1YBH FAD 0.002008 0.40475 7.40741
110 3I6B KDO 0.03952 0.41239 7.77778
111 5A2J ALA PRO ASP THR ARG PRO 0.04219 0.41855 7.78689
112 2RHQ GAX 0.003696 0.40395 8.16327
113 1YRX FMN 0.003821 0.42524 8.26446
114 4RJK PYR 0.01731 0.43589 8.33333
115 1SJW NGV 0.00408 0.42003 8.33333
116 3CQD ATP 0.00001306 0.47289 8.41424
117 4COQ SAN 0.0128 0.43072 8.50202
118 1QD0 RR6 0.001751 0.44354 8.59375
119 2HW1 ANP 0.000000562 0.4546 8.72483
120 2Q37 3AL 0.001319 0.47133 8.83978
121 2V5E SCR 0.007177 0.47137 8.91089
122 2Q1S NAI 0.00008892 0.41382 8.95062
123 2QCX PF1 0.0257 0.41131 9.12547
124 3BY8 MLT 0.01255 0.43685 9.15493
125 1TV5 N8E 0.03152 0.42154 9.25926
126 4WB7 ATP 0.008447 0.41335 9.5679
127 1RKD RIB 0.000000001512 0.64463 9.70874
128 1RKD ADP 0.00000000000001099 0.63429 9.70874
129 2CBZ ATP 0.03325 0.42121 10.5485
130 1SQ5 ADP 0.01259 0.40818 10.7143
131 3CF6 SP1 0.001034 0.4433 10.7784
132 2V6O FAD 0.0002152 0.42658 11.1111
133 3AB4 THR 0.02584 0.41462 11.236
134 2DTJ THR 0.04704 0.40092 11.236
135 4CVN ADP 0.03727 0.41381 12.0419
136 4IXW IXW 0.02102 0.40662 12.2047
137 2FYU FDN 0.003356 0.41566 12.9032
138 4EN4 ATP 0.001526 0.402 13.4615
139 1N9L FMN 0.003855 0.41342 15.5963
140 4F4S EFO 0.001432 0.46344 15.7895
141 3GCM 5GP 0.04184 0.44015 17.0732
142 2XEM SSV 0.0336 0.40863 18.6667
143 1FW1 GSH 0.009918 0.4086 18.9815
144 1VBO MAN MAN MAN 0.03924 0.40754 19.4631
145 1U4J MAN 0.02165 0.43586 19.4915
146 4CCO OGA 0.007779 0.43038 20
147 2E1A MSE 0.01604 0.41179 21.3333
148 1YOA FMN 0.03536 0.44003 21.3836
149 2JG1 ANP 0.00005678 0.40341 25
150 3QDT A2G GAL 0.001177 0.4961 25.8741
151 1T0S BML 0.0004726 0.51647 29.0698
152 1V1A ADP 0.000003293 0.41989 36.8932
153 2C49 ANP 0.0000001326 0.47292 41.7219
154 2C49 ADN 0.000002603 0.41067 41.7219
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