Receptor
PDB id Resolution Class Description Source Keywords
3COY 2.03 Å EC: 6.3.2.1 CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS PANTOTHENATE SYNTHETASE AT 2.05 ANG RESOLUTION- IN COMPLEX WITH SULPHONAI NHIBITOR 3 MYCOBACTERIUM TUBERCULOSIS MYCOBACTERIUM TUBERCULOSIS PANTOTHENATE BIOSYNTHESIS ENZYMLIGASE INHIBITORS DRUG DESIGN ATP-BINDING MAGNESIUM MEBINDING NUCLEOTIDE-BINDING
Ref.: INHIBITION OF MYCOBACTERIUM TUBERCULOSIS PANTOTHENA SYNTHETASE BY ANALOGUES OF THE REACTION INTERMEDIAT CHEMBIOCHEM V. 9 2606 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
53H A:301;
B:302;
Valid;
Valid;
none;
none;
Kd = 0.96 uM
459.477 C16 H25 N7 O7 S CC(C)...
EOH A:710;
A:711;
B:712;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
46.068 C2 H6 O CCO
GOL A:709;
Invalid;
none;
submit data
92.094 C3 H8 O3 C(C(C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3COW 1.8 Å EC: 6.3.2.1 CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS PANTOTHENATE SYNTHETASE AT 1.8 ANG RESOLUTION- IN COMPLEX WITH SULPHONAMI NHIBITOR 2 MYCOBACTERIUM TUBERCULOSIS MYCOBACTERIUM TUBERCULOSIS PANTOTHENATE BIOSYNTHESIS ENZYMLIGASE INHIBITORS DRUG DESIGN ATP-BINDING MAGNESIUM MEBINDING NUCLEOTIDE-BINDING
Ref.: INHIBITION OF MYCOBACTERIUM TUBERCULOSIS PANTOTHENA SYNTHETASE BY ANALOGUES OF THE REACTION INTERMEDIAT CHEMBIOCHEM V. 9 2606 2008
Members (36)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3IVG Kd = 50 uM FG5 C20 H18 N2 O6 S COc1ccc2c(....
2 2A84 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
3 1N2O - BAL C3 H7 N O2 C(CN)C(=O)....
4 1N2E - PAF C6 H11 O4 CC(C)(CO)[....
5 3IMC Kd = 1100 uM BZ3 C9 H9 N O COc1ccc2c(....
6 4G5Y Kd = 1.69 mM 0OC C6 H9 N O2 S2 CN(C)S(=O)....
7 3IOD Kd = 80 uM A6D C17 H18 N6 O5 S2 c1cc(cc(c1....
8 3COY Kd = 0.96 uM 53H C16 H25 N7 O7 S CC(C)(C)[C....
9 3IUB Kd = 29 uM FG2 C16 H15 N3 O4 S Cc1ccc(nc1....
10 3LE8 Kd = 860 nM 2B5 C21 H18 N2 O5 COc1ccc2c(....
11 3ISJ Kd = 210 uM A8D C11 H12 N2 O4 S COc1ccc2c(....
12 2A86 - BAL C3 H7 N O2 C(CN)C(=O)....
13 3IOE Kd = 540 uM A7D C14 H21 N5 O5 S c1nc(c2c(n....
14 4G5F Kd = 0.88 mM 15N C9 H8 O4 c1ccc2c(c1....
15 4EFK Kd = 3.18 mM 0OC C6 H9 N O2 S2 CN(C)S(=O)....
16 1N2B - PAF C6 H11 O4 CC(C)(CO)[....
17 1N2G - APC C11 H18 N5 O12 P3 c1nc(c2c(n....
18 4DDH Kd = 0.48 mM MS0 C11 H10 O4 COc1ccc2c(....
19 3COZ Kd = 2.7 uM 54H C15 H23 N7 O7 S CC(C)[C@H]....
20 1N2H - PAJ C16 H24 N5 O10 P CC(C)(CO)[....
21 3COW Kd = 0.125 uM 52H C16 H24 N6 O8 S CC(C)(C)[C....
22 3IOC Kd = 210 uM A5D C17 H19 N5 O3 S2 c1ccc(cc1)....
23 3IVC Kd = 76 uM FG4 C21 H17 N O6 COc1ccc2c(....
24 4EF6 Kd = 1.18 mM I2E C10 H10 O4 c1cc2c(cc1....
25 4DDK Kd = 5.13 mM 0HN C8 H6 O4 c1cc2c(cc1....
26 3IMG - BZ3 C9 H9 N O COc1ccc2c(....
27 4FZJ Kd = 0.74 mM 0W1 C8 H8 N2 O2 S Cc1c2cc(sc....
28 1N2I - PAJ C16 H24 N5 O10 P CC(C)(CO)[....
29 3IUE Kd = 1.5 uM FG3 C18 H17 N3 O6 S Cc1ccc(nc1....
30 3IVX Kd = 1.8 uM FG6 C20 H16 N2 O7 S COc1ccc2c(....
31 2A7X - AMP C10 H14 N5 O7 P c1nc(c2c(n....
32 4DE5 Kd = 0.67 mM 0JD C9 H8 O4 c1ccc2c(c1....
33 1N2J - PAF C6 H11 O4 CC(C)(CO)[....
34 3IME Kd = 1000 uM BZ2 C9 H6 O3 c1ccc2c(c1....
35 4DDM Kd = 3.48 mM 0HO C7 H4 N2 O2 S c1cc2c(cc1....
36 3IOB Kd = 380 uM A4D C10 H13 N5 O3 S c1nc(c2c(n....
70% Homology Family (36)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3IVG Kd = 50 uM FG5 C20 H18 N2 O6 S COc1ccc2c(....
2 2A84 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
3 1N2O - BAL C3 H7 N O2 C(CN)C(=O)....
4 1N2E - PAF C6 H11 O4 CC(C)(CO)[....
5 3IMC Kd = 1100 uM BZ3 C9 H9 N O COc1ccc2c(....
6 4G5Y Kd = 1.69 mM 0OC C6 H9 N O2 S2 CN(C)S(=O)....
7 3IOD Kd = 80 uM A6D C17 H18 N6 O5 S2 c1cc(cc(c1....
8 3COY Kd = 0.96 uM 53H C16 H25 N7 O7 S CC(C)(C)[C....
9 3IUB Kd = 29 uM FG2 C16 H15 N3 O4 S Cc1ccc(nc1....
10 3LE8 Kd = 860 nM 2B5 C21 H18 N2 O5 COc1ccc2c(....
11 3ISJ Kd = 210 uM A8D C11 H12 N2 O4 S COc1ccc2c(....
12 2A86 - BAL C3 H7 N O2 C(CN)C(=O)....
13 3IOE Kd = 540 uM A7D C14 H21 N5 O5 S c1nc(c2c(n....
14 4G5F Kd = 0.88 mM 15N C9 H8 O4 c1ccc2c(c1....
15 4EFK Kd = 3.18 mM 0OC C6 H9 N O2 S2 CN(C)S(=O)....
16 1N2B - PAF C6 H11 O4 CC(C)(CO)[....
17 1N2G - APC C11 H18 N5 O12 P3 c1nc(c2c(n....
18 4DDH Kd = 0.48 mM MS0 C11 H10 O4 COc1ccc2c(....
19 3COZ Kd = 2.7 uM 54H C15 H23 N7 O7 S CC(C)[C@H]....
20 1N2H - PAJ C16 H24 N5 O10 P CC(C)(CO)[....
21 3COW Kd = 0.125 uM 52H C16 H24 N6 O8 S CC(C)(C)[C....
22 3IOC Kd = 210 uM A5D C17 H19 N5 O3 S2 c1ccc(cc1)....
23 3IVC Kd = 76 uM FG4 C21 H17 N O6 COc1ccc2c(....
24 4EF6 Kd = 1.18 mM I2E C10 H10 O4 c1cc2c(cc1....
25 4DDK Kd = 5.13 mM 0HN C8 H6 O4 c1cc2c(cc1....
26 3IMG - BZ3 C9 H9 N O COc1ccc2c(....
27 4FZJ Kd = 0.74 mM 0W1 C8 H8 N2 O2 S Cc1c2cc(sc....
28 1N2I - PAJ C16 H24 N5 O10 P CC(C)(CO)[....
29 3IUE Kd = 1.5 uM FG3 C18 H17 N3 O6 S Cc1ccc(nc1....
30 3IVX Kd = 1.8 uM FG6 C20 H16 N2 O7 S COc1ccc2c(....
31 2A7X - AMP C10 H14 N5 O7 P c1nc(c2c(n....
32 4DE5 Kd = 0.67 mM 0JD C9 H8 O4 c1ccc2c(c1....
33 1N2J - PAF C6 H11 O4 CC(C)(CO)[....
34 3IME Kd = 1000 uM BZ2 C9 H6 O3 c1ccc2c(c1....
35 4DDM Kd = 3.48 mM 0HO C7 H4 N2 O2 S c1cc2c(cc1....
36 3IOB Kd = 380 uM A4D C10 H13 N5 O3 S c1nc(c2c(n....
50% Homology Family (36)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3IVG Kd = 50 uM FG5 C20 H18 N2 O6 S COc1ccc2c(....
2 2A84 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
3 1N2O - BAL C3 H7 N O2 C(CN)C(=O)....
4 1N2E - PAF C6 H11 O4 CC(C)(CO)[....
5 3IMC Kd = 1100 uM BZ3 C9 H9 N O COc1ccc2c(....
6 4G5Y Kd = 1.69 mM 0OC C6 H9 N O2 S2 CN(C)S(=O)....
7 3IOD Kd = 80 uM A6D C17 H18 N6 O5 S2 c1cc(cc(c1....
8 3COY Kd = 0.96 uM 53H C16 H25 N7 O7 S CC(C)(C)[C....
9 3IUB Kd = 29 uM FG2 C16 H15 N3 O4 S Cc1ccc(nc1....
10 3LE8 Kd = 860 nM 2B5 C21 H18 N2 O5 COc1ccc2c(....
11 3ISJ Kd = 210 uM A8D C11 H12 N2 O4 S COc1ccc2c(....
12 2A86 - BAL C3 H7 N O2 C(CN)C(=O)....
13 3IOE Kd = 540 uM A7D C14 H21 N5 O5 S c1nc(c2c(n....
14 4G5F Kd = 0.88 mM 15N C9 H8 O4 c1ccc2c(c1....
15 4EFK Kd = 3.18 mM 0OC C6 H9 N O2 S2 CN(C)S(=O)....
16 1N2B - PAF C6 H11 O4 CC(C)(CO)[....
17 1N2G - APC C11 H18 N5 O12 P3 c1nc(c2c(n....
18 4DDH Kd = 0.48 mM MS0 C11 H10 O4 COc1ccc2c(....
19 3COZ Kd = 2.7 uM 54H C15 H23 N7 O7 S CC(C)[C@H]....
20 1N2H - PAJ C16 H24 N5 O10 P CC(C)(CO)[....
21 3COW Kd = 0.125 uM 52H C16 H24 N6 O8 S CC(C)(C)[C....
22 3IOC Kd = 210 uM A5D C17 H19 N5 O3 S2 c1ccc(cc1)....
23 3IVC Kd = 76 uM FG4 C21 H17 N O6 COc1ccc2c(....
24 4EF6 Kd = 1.18 mM I2E C10 H10 O4 c1cc2c(cc1....
25 4DDK Kd = 5.13 mM 0HN C8 H6 O4 c1cc2c(cc1....
26 3IMG - BZ3 C9 H9 N O COc1ccc2c(....
27 4FZJ Kd = 0.74 mM 0W1 C8 H8 N2 O2 S Cc1c2cc(sc....
28 1N2I - PAJ C16 H24 N5 O10 P CC(C)(CO)[....
29 3IUE Kd = 1.5 uM FG3 C18 H17 N3 O6 S Cc1ccc(nc1....
30 3IVX Kd = 1.8 uM FG6 C20 H16 N2 O7 S COc1ccc2c(....
31 2A7X - AMP C10 H14 N5 O7 P c1nc(c2c(n....
32 4DE5 Kd = 0.67 mM 0JD C9 H8 O4 c1ccc2c(c1....
33 1N2J - PAF C6 H11 O4 CC(C)(CO)[....
34 3IME Kd = 1000 uM BZ2 C9 H6 O3 c1ccc2c(c1....
35 4DDM Kd = 3.48 mM 0HO C7 H4 N2 O2 S c1cc2c(cc1....
36 3IOB Kd = 380 uM A4D C10 H13 N5 O3 S c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 53H; Similar ligands found: 235
No: Ligand ECFP6 Tc MDL keys Tc
1 53H 1 1
2 52H 0.821429 1
3 A5A 0.819277 0.963855
4 SSA 0.809524 0.908046
5 VMS 0.8 0.987952
6 54H 0.8 0.987952
7 TSB 0.790698 0.952381
8 LSS 0.772727 0.953488
9 5CA 0.770115 0.908046
10 DSZ 0.752809 0.908046
11 NVA LMS 0.744444 0.909091
12 LEU LMS 0.736264 0.953488
13 NSS 0.733333 0.908046
14 KAA 0.728261 0.877778
15 GSU 0.728261 0.908046
16 G5A 0.72093 0.908046
17 YSA 0.690722 0.908046
18 5AS 0.690476 0.908046
19 P5A 0.639175 0.868132
20 WSA 0.638095 0.918605
21 4YB 0.584906 0.88764
22 5AL 0.578947 0.811765
23 649 0.577982 0.868132
24 SON 0.571429 0.772727
25 AHX 0.57 0.766667
26 A 0.563218 0.776471
27 AMP 0.563218 0.776471
28 ABM 0.561798 0.77907
29 SRP 0.55102 0.772727
30 AMP MG 0.550562 0.738636
31 CA0 0.548387 0.781609
32 A2D 0.544444 0.77907
33 5X8 0.542553 0.689655
34 SLU 0.542373 0.897727
35 3DH 0.54023 0.697674
36 SRA 0.539326 0.802326
37 TXA 0.538462 0.793103
38 AN2 0.537634 0.790698
39 5N5 0.536585 0.674419
40 8QN 0.534653 0.811765
41 AOC 0.533333 0.697674
42 BA3 0.532609 0.77907
43 A12 0.532609 0.752809
44 AP2 0.532609 0.752809
45 AU1 0.531915 0.781609
46 M33 0.531915 0.790698
47 ADX 0.531915 0.894118
48 ADN 0.530864 0.694118
49 XYA 0.530864 0.694118
50 RAB 0.530864 0.694118
51 5CD 0.53012 0.682353
52 PAJ 0.529412 0.818182
53 B4P 0.526882 0.77907
54 AP5 0.526882 0.77907
55 ADP 0.526882 0.77907
56 DAL AMP 0.524752 0.790698
57 PTJ 0.52381 0.827586
58 PRX 0.520833 0.761364
59 GAP 0.520408 0.761364
60 XAH 0.518519 0.741935
61 ADP MG 0.515789 0.75
62 SA8 0.515464 0.645161
63 AMO 0.514563 0.772727
64 A4D 0.511905 0.694118
65 EP4 0.511628 0.701149
66 ACP 0.510417 0.761364
67 BEF ADP 0.510417 0.733333
68 ATP 0.510417 0.77907
69 50T 0.510417 0.75
70 ADP BEF 0.510417 0.733333
71 NB8 0.509434 0.766667
72 ME8 0.509434 0.76087
73 DTA 0.505747 0.709302
74 M2T 0.505747 0.724138
75 AR6 0.505155 0.77907
76 5FA 0.505155 0.77907
77 AQP 0.505155 0.77907
78 APR 0.505155 0.77907
79 APC 0.505155 0.752809
80 ANP 0.50505 0.781609
81 ADP PO3 0.5 0.776471
82 SAP 0.5 0.804598
83 MTA 0.5 0.697674
84 LAD 0.5 0.73913
85 4AD 0.5 0.764045
86 ADV 0.5 0.752809
87 AD9 0.5 0.761364
88 RBY 0.5 0.752809
89 AGS 0.5 0.804598
90 DLL 0.495238 0.790698
91 ATF 0.49505 0.752809
92 SAI 0.494949 0.648352
93 ATP MG 0.494949 0.75
94 SAH 0.494949 0.674157
95 SFG 0.494845 0.659091
96 7MD 0.491071 0.741935
97 OAD 0.490566 0.802326
98 3UK 0.490566 0.781609
99 OOB 0.490385 0.790698
100 ANP MG 0.490196 0.764045
101 SMM 0.490196 0.680851
102 S7M 0.490196 0.666667
103 ACQ 0.49 0.761364
104 TAT 0.49 0.793103
105 SAM 0.49 0.666667
106 A3S 0.489583 0.689655
107 6RE 0.48913 0.634409
108 9SN 0.486239 0.747253
109 EEM 0.485149 0.631579
110 YAP 0.481818 0.764045
111 FA5 0.481818 0.772727
112 1ZZ 0.481481 0.741935
113 FYA 0.481481 0.75
114 3OD 0.481481 0.802326
115 00A 0.481132 0.755556
116 A22 0.480769 0.770115
117 MAP 0.480769 0.764045
118 ALF ADP 0.480392 0.725275
119 ADP ALF 0.480392 0.725275
120 A3T 0.479592 0.717647
121 J7C 0.478723 0.641304
122 A3N 0.478723 0.651685
123 YLP 0.478261 0.726316
124 48N 0.478261 0.766667
125 MYR AMP 0.477064 0.723404
126 25A 0.47619 0.77907
127 5SV 0.47619 0.728261
128 VO4 ADP 0.475728 0.770115
129 ADP VO4 0.475728 0.770115
130 S4M 0.473684 0.628866
131 GJV 0.473684 0.62766
132 WAQ 0.472222 0.755556
133 PR8 0.472222 0.731183
134 ADQ 0.471698 0.761364
135 0UM 0.471698 0.638298
136 A1R 0.471698 0.736264
137 ARG AMP 0.469565 0.697917
138 MAO 0.46875 0.691489
139 DSH 0.468085 0.641304
140 NEC 0.468085 0.655172
141 BIS 0.46789 0.736264
142 YLC 0.466102 0.741935
143 YLB 0.466102 0.726316
144 7MC 0.466102 0.744681
145 TYR AMP 0.464286 0.752809
146 ADP BMA 0.462963 0.741573
147 K15 0.462963 0.625
148 AYB 0.46281 0.71875
149 ZAS 0.462366 0.674157
150 6V0 0.461538 0.747253
151 AMP DBH 0.460177 0.722222
152 A7D 0.459184 0.681818
153 ALF ADP 3PG 0.457627 0.72043
154 LA8 ALF 3PG 0.457627 0.72043
155 TYM 0.457627 0.772727
156 7C5 0.45614 0.7
157 COD 0.455285 0.776596
158 SXZ 0.454545 0.703297
159 MHZ 0.454545 0.639175
160 JB6 0.454545 0.775281
161 YLA 0.454545 0.708333
162 62X 0.453704 0.645833
163 A3G 0.452632 0.681818
164 5AD 0.452381 0.650602
165 SO8 0.45098 0.712644
166 25L 0.45045 0.770115
167 2VA 0.45 0.741176
168 NAX 0.449153 0.731183
169 YLY 0.448819 0.71875
170 TAD 0.448276 0.758242
171 4UV 0.447368 0.764045
172 A A 0.445455 0.758621
173 TXE 0.445378 0.755556
174 OMR 0.445378 0.734043
175 LAQ 0.444444 0.76087
176 AHZ 0.444444 0.741935
177 A5D 0.441176 0.709302
178 LPA AMP 0.440678 0.741935
179 4UU 0.439655 0.764045
180 KB1 0.4375 0.621053
181 4UW 0.436975 0.758242
182 NAI 0.436975 0.755556
183 TXD 0.436975 0.755556
184 DND 0.436975 0.772727
185 NXX 0.436975 0.772727
186 VRT 0.436893 0.677778
187 3AM 0.43617 0.744186
188 GTA 0.435897 0.741935
189 NAD IBO 0.435484 0.804598
190 GEK 0.435185 0.688889
191 IOT 0.434426 0.701031
192 AF3 ADP 3PG 0.433333 0.72043
193 3NZ 0.432432 0.688889
194 Y3J 0.431818 0.616279
195 7D7 0.430233 0.632184
196 7D5 0.430108 0.707865
197 ATP A A A 0.429825 0.767442
198 AP0 0.429752 0.747253
199 CNA 0.427419 0.772727
200 AR6 AR6 0.42735 0.758621
201 AFH 0.42735 0.72043
202 D3Y 0.425926 0.674157
203 A3P 0.424242 0.776471
204 A2P 0.424242 0.764706
205 KH3 0.423729 0.618557
206 S8M 0.422018 0.688889
207 T5A 0.419355 0.726316
208 G3A 0.418803 0.747253
209 594 0.418605 0.795918
210 BT5 0.417323 0.71875
211 N0B 0.416667 0.708333
212 BS5 0.416 0.762887
213 G5P 0.415254 0.747253
214 AAT 0.415094 0.62766
215 A3D 0.414062 0.802326
216 UP5 0.413223 0.764045
217 FB0 0.413043 0.7
218 NAJ PZO 0.410853 0.747253
219 A6D 0.410714 0.677419
220 2AM 0.410526 0.735632
221 NAD 0.409449 0.790698
222 4TA 0.409449 0.715789
223 NAQ 0.409091 0.786517
224 4TC 0.406504 0.747253
225 UPA 0.406504 0.755556
226 DZD 0.40625 0.73913
227 V3L 0.40566 0.77907
228 2A5 0.403846 0.722222
229 A4P 0.403226 0.693878
230 PPS 0.401869 0.872093
231 NAE 0.401515 0.784091
232 ATR 0.4 0.755814
233 7D3 0.4 0.711111
234 PAP 0.4 0.767442
235 NVA 2AD 0.4 0.655556
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3COW; Ligand: 52H; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 3cow.bio1) has 42 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3COW; Ligand: 52H; Similar sites found: 28
This union binding pocket(no: 2) in the query (biounit: 3cow.bio1) has 45 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3JRX S1A 0.03478 0.40027 1.66113
2 3ZIU LSS 0.00000576 0.41197 1.99336
3 2PID YSA 0.00001517 0.41256 2.24719
4 1PFY MSP 0.000009007 0.41365 2.32558
5 2YLN CYS 0.03763 0.41859 3.18021
6 3C8Z 5CA 0.00001508 0.55124 3.32226
7 4E2J MOF 0.01038 0.41359 3.6
8 5UFS 1TA 0.02043 0.40034 3.62903
9 1G27 BB1 0.0266 0.40308 4.16667
10 4GQY AMP 0.02535 0.42033 4.24242
11 3R9V DXC 0.002825 0.42978 4.31894
12 1R6T TYM 0.0001066 0.4568 4.65116
13 4J75 TYM 0.000005874 0.43172 4.88998
14 4IZY 1J2 0.02476 0.40178 5.31561
15 1R4W GSH 0.03057 0.41247 5.75221
16 2QTR NXX 0.0001706 0.407 5.82011
17 1S9D AFB 0.03721 0.41143 6.40394
18 2X1L ADN 0.00006608 0.5435 6.97674
19 3ND6 ATP 0.0001626 0.40209 7.30897
20 3HUN ZZ7 0.03785 0.41468 8.30565
21 2XG5 EC5 0.01024 0.45217 8.7156
22 2XG5 EC2 0.01024 0.45217 8.7156
23 5BXV MGP 0.02564 0.42693 9.09091
24 3KFL ME8 0.0000005149 0.44981 9.63455
25 1WS1 BB2 0.03719 0.40174 12.8205
26 3KP6 SAL 0.008535 0.45594 13.245
27 3HL4 CDC 0.001182 0.46333 14.4068
28 1N1D C2G 0.003558 0.42834 17.0543
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