Receptor
PDB id Resolution Class Description Source Keywords
3W8S 2.07 Å EC: 2.-.-.- CRYSTAL STRUCTURE OF MONOMERIC NA-GST-3, A GLUTATHIONE S-TRA FROM THE MAJOR HUMAN HOOKWORM PARASITE NECATOR AMERICANUS NECATOR AMERICANUS GST DETOXIFICATION GSH TRANSFERASE
Ref.: STRUCTURE OF MONOMERIC NA-GST-3, A GLUTATHIONE S-TR FROM THE MAJOR HUMAN HOOKWORM PARASITE NECATOR AMER ACTA CRYSTALLOGR.,SECT.F V. 69 839 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GOL A:305;
A:304;
A:303;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
GSH A:301;
Valid;
none;
submit data
307.323 C10 H17 N3 O6 S C(CC(...
SO4 A:302;
Invalid;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3W8S 2.07 Å EC: 2.-.-.- CRYSTAL STRUCTURE OF MONOMERIC NA-GST-3, A GLUTATHIONE S-TRA FROM THE MAJOR HUMAN HOOKWORM PARASITE NECATOR AMERICANUS NECATOR AMERICANUS GST DETOXIFICATION GSH TRANSFERASE
Ref.: STRUCTURE OF MONOMERIC NA-GST-3, A GLUTATHIONE S-TR FROM THE MAJOR HUMAN HOOKWORM PARASITE NECATOR AMER ACTA CRYSTALLOGR.,SECT.F V. 69 839 2013
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 236 families.
1 3W8S - GSH C10 H17 N3 O6 S C(CC(=O)N[....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 211 families.
1 2ON5 - GSH C10 H17 N3 O6 S C(CC(=O)N[....
2 1ZL9 - GSH C10 H17 N3 O6 S C(CC(=O)N[....
3 3W8S - GSH C10 H17 N3 O6 S C(CC(=O)N[....
50% Homology Family (27)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 18 families.
1 1M0U - GSH C10 H17 N3 O6 S C(CC(=O)N[....
2 1GSQ - GDN C16 H19 N5 O10 S c1cc(c(cc1....
3 5H5L - GSH C10 H17 N3 O6 S C(CC(=O)N[....
4 1ZL9 - GSH C10 H17 N3 O6 S C(CC(=O)N[....
5 3W8S - GSH C10 H17 N3 O6 S C(CC(=O)N[....
6 2VD1 ic50 = 0.138 uM D28 C17 H13 F N2 O3 S Cc1cc(ccc1....
7 4EC0 - GSH C10 H17 N3 O6 S C(CC(=O)N[....
8 5AIX Kd = 0.17 uM KRX C20 H22 F3 N3 O2 COc1cccc(c....
9 2CVD Kd = 0.8 uM HQL C22 H27 N5 O c1ccc(cc1)....
10 3VI7 - GSH C10 H17 N3 O6 S C(CC(=O)N[....
11 4EDY - GSH C10 H17 N3 O6 S C(CC(=O)N[....
12 4EE0 - GSF C10 H17 N3 O8 S C(CC(=O)N[....
13 5AIS Kd = 0.57 uM CWC C19 H22 N4 O CN(C)CCCC(....
14 2VCX ic50 = 0.021 uM D26 C12 H9 N3 S c1ccc(cc1)....
15 3VI5 - GSH C10 H17 N3 O6 S C(CC(=O)N[....
16 5AIV Kd = 0.65 uM M1W C15 H16 N4 O3 COCCCNC(=O....
17 1V40 - GSH C10 H17 N3 O6 S C(CC(=O)N[....
18 1IYI - GSH C10 H17 N3 O6 S C(CC(=O)N[....
19 2VCW ic50 = 890 uM ZZA C10 H8 N2 O2 c1ccc(cc1)....
20 2VCZ - VC3 C9 H7 N3 O2 c1cc(ccc1c....
21 4EDZ - GSH C10 H17 N3 O6 S C(CC(=O)N[....
22 3EE2 ic50 ~ 65 uM NZO C14 H11 N3 O3 S COC(=O)Nc1....
23 1IYH - GSH C10 H17 N3 O6 S C(CC(=O)N[....
24 2VD0 ic50 = 11.6 uM D27 C18 H17 N O5 COc1ccc(cc....
25 2VCQ ic50 = 0.92 uM D25 C12 H9 N3 O c1ccc(cc1)....
26 3VPQ - GSH C10 H17 N3 O6 S C(CC(=O)N[....
27 1PD2 - GSH C10 H17 N3 O6 S C(CC(=O)N[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GSH; Similar ligands found: 50
No: Ligand ECFP6 Tc MDL keys Tc
1 GSH 1 1
2 HCG 0.75 0.973684
3 HGS 0.730769 0.925
4 GSM 0.690909 0.878049
5 GDS 0.672727 0.837209
6 GS8 0.672727 0.840909
7 GTS 0.672727 0.660714
8 GSF 0.660714 0.72549
9 AHE 0.649123 0.9
10 3GC 0.645833 0.918919
11 HGD 0.637931 0.837209
12 GCG 0.6 0.860465
13 KGT 0.592593 0.923077
14 TGG 0.587302 0.9
15 TS5 0.573529 0.880952
16 GSB 0.528571 0.878049
17 0HH 0.528571 0.782609
18 GSO 0.521127 0.857143
19 BOB 0.493506 0.75
20 GTB 0.493333 0.631579
21 GBI 0.486842 0.782609
22 48T 0.481013 0.8
23 ESG 0.480519 0.62069
24 GTD 0.480519 0.6
25 L9X 0.480519 0.62069
26 1R4 0.474359 0.62069
27 GIP 0.474359 0.6
28 GPS 0.468354 0.72
29 GPR 0.468354 0.72
30 GBP 0.468354 0.6
31 GAZ 0.457831 0.679245
32 GVX 0.45679 0.8
33 HFV 0.447761 0.8
34 ASV 0.446154 0.9
35 GNB 0.445783 0.6
36 VB1 0.444444 0.9
37 W05 0.444444 0.923077
38 LZ6 0.436782 0.692308
39 ACV 0.430769 0.878049
40 BCV 0.424242 0.9
41 CDH 0.424242 0.818182
42 2G2 0.42029 0.615385
43 HGA 0.42 0.622222
44 MEQ 0.411765 0.658537
45 M8F 0.411765 0.837209
46 TS4 0.410256 0.804348
47 M9F 0.405797 0.837209
48 M2W 0.4 0.8
49 KKA 0.4 0.894737
50 ACW 0.4 0.8
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3W8S; Ligand: GSH; Similar sites found: 485
This union binding pocket(no: 1) in the query (biounit: 3w8s.bio1) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2PFC PLM 0.001139 0.43721 None
2 3R51 MMA 0.003862 0.43181 None
3 2AE2 PTO 0.01452 0.42483 None
4 2AE2 NAP 0.01452 0.42483 None
5 2F01 BTN 0.03353 0.42322 None
6 4E1N TQX 0.006026 0.42105 None
7 1UO5 PIH 0.01781 0.41615 None
8 1OGD RIP 0.002727 0.41319 None
9 4CO3 ATP 0.04247 0.40366 None
10 1KYV RBF 0.01074 0.40297 None
11 4RJK PYR 0.002146 0.46411 1.45631
12 2BNE U5P 0.005431 0.43781 1.45631
13 2BNF UTP 0.01086 0.4288 1.45631
14 1NZY BCA 0.006016 0.42874 1.45631
15 4KGM ATP 0.002335 0.42424 1.45631
16 1VR0 3SL 0.003138 0.41363 1.45631
17 2C7G FAD 0.0498 0.40983 1.45631
18 4WNB 4BN 0.006201 0.41314 1.60428
19 1DXY NAD 0.003133 0.43994 1.94175
20 2J8Z NAP 0.006308 0.42919 1.94175
21 1CBF SAH 0.003462 0.42178 1.94175
22 2QQF A1R 0.01287 0.41117 1.94175
23 2EI4 22B 0.03284 0.41026 1.94175
24 2HXT EHM 0.006863 0.40704 1.94175
25 2OD9 A1R NCA 0.02684 0.402 1.94175
26 3UEC ALA ARG TPO LYS 0.005835 0.40886 2.05479
27 1NU4 MLA 0.005415 0.44318 2.06186
28 4TR1 GSH 0.003887 0.42501 2.17391
29 4W6Z 8ID 0.002286 0.45798 2.42718
30 1LTH NAD 0.008863 0.44859 2.42718
31 2GSD NAD 0.005646 0.43876 2.42718
32 3B1F NAD 0.004334 0.4273 2.42718
33 1P4C FMN 0.02935 0.42668 2.42718
34 1VDC FAD 0.0185 0.42582 2.42718
35 2ZJ3 G6P 0.004317 0.42378 2.42718
36 2P41 SAH 0.004098 0.42283 2.42718
37 1B8U NAD 0.006759 0.41716 2.42718
38 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.0302 0.4167 2.42718
39 1B8U OAA 0.01634 0.41418 2.42718
40 1P72 ADP 0.01661 0.41268 2.42718
41 4E28 9MZ 0.005016 0.40531 2.42718
42 3DX5 DHB 0.006811 0.40244 2.42718
43 1NW5 SAM 0.01388 0.40186 2.42718
44 3S9K CIT 0.001667 0.48564 2.54237
45 1JUV NDP 0.01778 0.4063 2.59067
46 1Q3P GLU ALA GLN THR ARG LEU 0.0006126 0.45354 2.75229
47 3ACC 5GP 0.002816 0.41555 2.76243
48 2D37 NAD 0.02249 0.40303 2.84091
49 2D37 FMN 0.02103 0.40303 2.84091
50 1R5A GTS 0.00002781 0.49827 2.91262
51 3RFV NAI 0.001542 0.45518 2.91262
52 1B9I PXG 0.00242 0.44009 2.91262
53 3CKZ ZMR 0.009229 0.43501 2.91262
54 4QN7 G39 0.007045 0.43434 2.91262
55 1MVN PCO 0.02002 0.42961 2.91262
56 1A59 COA 0.002974 0.4288 2.91262
57 1D6H COA 0.0163 0.42515 2.91262
58 1H6C NDP 0.0147 0.42167 2.91262
59 1C4U IH1 0.004723 0.42115 2.91262
60 4GYW UDP 0.01188 0.42051 2.91262
61 3VHZ L2P GLC MAN SGA 0.03995 0.42025 2.91262
62 3VHZ SOG 0.03545 0.42025 2.91262
63 3GB5 FMN 0.005428 0.41949 2.91262
64 2C4I BTN 0.004036 0.41896 2.91262
65 2E2R 2OH 0.01453 0.41876 2.91262
66 1RYD NDP 0.0179 0.41769 2.91262
67 1M7Y PPG 0.01414 0.41466 2.91262
68 1H6C SIN 0.02413 0.41353 2.91262
69 2Q2V NAD 0.0284 0.40426 2.91262
70 2FMD MAN MAN 0.01264 0.40362 2.91262
71 3V1V GST 0.01053 0.40334 2.91262
72 1X54 4AD 0.01826 0.40298 2.91262
73 2ZX7 ZX7 0.0278 0.40189 2.91262
74 4JCA CIT 0.0006637 0.47854 2.99401
75 3UIE ADX 0.005016 0.41276 3
76 4BAS GNP 0.006009 0.41938 3.01508
77 2UZ2 BTN 0.008409 0.40547 3.07692
78 3L1N PLM 0.008737 0.40872 3.09278
79 3TCT 3MI 0.0484 0.40847 3.14961
80 1KOL NAD 0.001559 0.46565 3.39806
81 3NKS FAD 0.003322 0.45162 3.39806
82 1ZK7 FAD 0.00532 0.44995 3.39806
83 2V7T SAH 0.01661 0.44838 3.39806
84 1IYE PGU 0.00287 0.44729 3.39806
85 4G1V FAD 0.002794 0.44215 3.39806
86 1U7Z PMT 0.004579 0.44059 3.39806
87 4R33 SAH 0.005622 0.43652 3.39806
88 4R33 TRP 0.005622 0.43652 3.39806
89 1DSS NAD 0.003731 0.43505 3.39806
90 3K37 BCZ 0.02602 0.43362 3.39806
91 4NM5 ADP 0.003561 0.43102 3.39806
92 1LVL FAD 0.01331 0.42932 3.39806
93 4USQ FAD 0.009495 0.42726 3.39806
94 3FC2 IBI 0.007565 0.42695 3.39806
95 3OZG SSI 0.003065 0.42401 3.39806
96 1O9U ADZ 0.00574 0.42368 3.39806
97 1C3V NDP 0.009598 0.42352 3.39806
98 1SAZ ACP 0.04122 0.42348 3.39806
99 1PEA ACM 0.006739 0.41291 3.39806
100 1LVL NAD 0.01043 0.40897 3.39806
101 2C5S AMP 0.0009258 0.40889 3.39806
102 1YS4 NAP 0.01145 0.40886 3.39806
103 2QDT I38 0.007466 0.40766 3.39806
104 3NKS ACJ 0.007516 0.40753 3.39806
105 1G0N PHH 0.03689 0.40659 3.39806
106 4CML 52N 0.02142 0.40333 3.39806
107 1G0N NDP 0.04002 0.40225 3.39806
108 4IU0 ABH 0.01656 0.40183 3.39806
109 2NT8 ATP 0.02661 0.40097 3.39806
110 1JSH SIA GAL 0.01505 0.40366 3.40909
111 2JAR UMP 0.01025 0.40574 3.5
112 4DVE BTN 0.004691 0.40913 3.53535
113 3DCM SAM 0.005677 0.41865 3.64583
114 1XX6 ADP 0.00539 0.40664 3.66492
115 2FWP CIT 0.02142 0.40765 3.82514
116 3WBF NAP 0.0001857 0.49788 3.8835
117 3WBF API 0.0002535 0.49788 3.8835
118 1RYI FAD 0.002074 0.4654 3.8835
119 1R6D DAU 0.004921 0.45658 3.8835
120 4HZX G39 0.003359 0.45355 3.8835
121 3V1U NAD 0.0017 0.45017 3.8835
122 1WVG APR 0.002108 0.44602 3.8835
123 1RYI GOA 0.006264 0.44479 3.8835
124 4IOK ADP 0.003163 0.43976 3.8835
125 2PT9 2MH 0.005186 0.43931 3.8835
126 4NE2 ADP 0.006943 0.43234 3.8835
127 4NE2 SH2 0.007786 0.43234 3.8835
128 3ZPG 5GP 0.004008 0.43105 3.8835
129 1R6D NAD 0.01744 0.43079 3.8835
130 3SUC ATP 0.003475 0.4228 3.8835
131 2PT9 S4M 0.007224 0.42232 3.8835
132 1H2B NAJ 0.01156 0.42221 3.8835
133 4B8V NDG NAG NAG NAG 0.008782 0.42 3.8835
134 1R6W 164 0.003859 0.41978 3.8835
135 3P0K FAD 0.008684 0.41412 3.8835
136 1GSA GSH 0.02598 0.41382 3.8835
137 1A8R GTP 0.008045 0.41211 3.8835
138 2VHJ ADP 0.01178 0.40494 3.8835
139 4PLG OXM 0.03663 0.40314 3.8835
140 4PLG NAI 0.03663 0.40314 3.8835
141 1O7N IND 0.01727 0.40103 3.8835
142 2XK9 XK9 0.03595 0.40056 3.8835
143 3U4C NDP 0.01627 0.41064 3.91459
144 3QDY CBS 0.0009536 0.44292 4.1958
145 3QDW NDG 0.00163 0.40261 4.1958
146 3QDX CBS 0.002035 0.40022 4.1958
147 4IAE 1DX 0.03681 0.41253 4.2328
148 2ALG HP6 0.004324 0.42559 4.34783
149 2ALG DAO 0.004324 0.42559 4.34783
150 4FR3 LYS ARG ARG LYS SEP VAL 0.006913 0.45964 4.36893
151 1V35 NAI 0.002998 0.45791 4.36893
152 1TIW TFB 0.004068 0.44863 4.36893
153 1TIW FAD 0.004068 0.44863 4.36893
154 4O8A FAD 0.002698 0.4485 4.36893
155 4NTD FAD 0.004979 0.44455 4.36893
156 3GE7 AFQ 0.003816 0.44421 4.36893
157 3IU9 T07 0.01101 0.4433 4.36893
158 2TPL HPP 0.003068 0.43881 4.36893
159 4JK3 NAD 0.004905 0.4341 4.36893
160 1YOE RIB 0.006672 0.4281 4.36893
161 1R37 NAD 0.009889 0.42645 4.36893
162 1PDZ PGA 0.0002085 0.42573 4.36893
163 4QED NAP 0.008084 0.42565 4.36893
164 1I36 NAP 0.005975 0.42287 4.36893
165 4FR3 0V4 0.04721 0.41794 4.36893
166 3UH0 TSB 0.009351 0.41432 4.36893
167 3NOJ PYR 0.001755 0.41284 4.36893
168 1PR9 NAP 0.01868 0.41264 4.36893
169 1LYX PGA 0.005382 0.41147 4.36893
170 1BGQ RDC 0.01454 0.41022 4.36893
171 3PVT 3HC 0.02824 0.40844 4.36893
172 1WNG SAH 0.01054 0.40704 4.36893
173 2NX1 PEP 0.02049 0.40485 4.36893
174 2OWZ CIT 0.01439 0.40451 4.36893
175 3ZY6 GFB 0.01421 0.40313 4.36893
176 2PNZ UDP 0.02106 0.40164 4.36893
177 2OWZ F6P 0.04635 0.40013 4.36893
178 1DKU AP2 0.02532 0.40005 4.36893
179 3RO7 TDR 0.01501 0.41094 4.5283
180 3RK0 AMP 0.001544 0.43171 4.64135
181 1BTN I3P 0.004579 0.44911 4.71698
182 3LTW HLZ 0.0001483 0.46891 4.85437
183 2PWY SAH 0.001304 0.45185 4.85437
184 1T57 FMN 0.001255 0.45076 4.85437
185 1Q0H NDP 0.007658 0.44414 4.85437
186 1Q0H FOM 0.007053 0.44414 4.85437
187 3JDW ORN 0.002538 0.42747 4.85437
188 4KXV TDP DX5 0.0134 0.42455 4.85437
189 1UZN NAP 0.00306 0.42404 4.85437
190 1RM4 NDP 0.02863 0.42361 4.85437
191 3NYQ AMP 0.01141 0.42247 4.85437
192 3NYQ MCA 0.01076 0.42247 4.85437
193 1ZFJ IMP 0.01929 0.42168 4.85437
194 3RKR NAP 0.002371 0.42136 4.85437
195 1ML4 PAL 0.005191 0.42124 4.85437
196 3VKX T3 0.005901 0.41883 4.85437
197 3QO8 SSA 0.004375 0.41748 4.85437
198 1TB4 PEJ 0.01531 0.41308 4.85437
199 1H9A NAP 0.02224 0.41024 4.85437
200 2JE7 XMM 0.01631 0.40798 4.85437
201 3ZEI AWH 0.01885 0.40775 4.85437
202 1R18 SAH 0.01279 0.40676 4.85437
203 2CSN CKI 0.01712 0.40566 4.85437
204 3UCJ AZM 0.005039 0.40521 4.85437
205 2EFJ SAH 0.00981 0.40464 4.85437
206 1LC8 33P 0.02263 0.4016 4.85437
207 4C2G ALA ALA ALA ALA 0.00627 0.40132 4.85437
208 4RNV HBA 0.01232 0.40042 4.85437
209 1I2B NAD 0.01121 0.44082 4.9505
210 1I2B UPG 0.01121 0.44082 4.9505
211 1I2B USQ 0.01121 0.44082 4.9505
212 1YOA FMN 0.02179 0.41156 5.03145
213 1SBZ FMN 0.03063 0.40165 5.07614
214 1C0I BE2 0.0006435 0.49338 5.33981
215 1C0I FAD 0.0006435 0.49338 5.33981
216 1L2T ATP 0.001511 0.44904 5.33981
217 2DTX BMA 0.004306 0.44853 5.33981
218 3A8U PLP 0.004428 0.43019 5.33981
219 4TSK NDP 0.02022 0.42974 5.33981
220 4USS GSH 0.002665 0.42365 5.33981
221 1TOI HCI 0.009002 0.42224 5.33981
222 1RKD RIB 0.01152 0.42112 5.33981
223 1RKD ADP 0.01152 0.42112 5.33981
224 4K5S FAD 0.01281 0.42017 5.33981
225 1YBH FAD 0.02102 0.41636 5.33981
226 4K5S PM0 0.03169 0.41532 5.33981
227 5YAS FAC 0.003389 0.41496 5.33981
228 2BLE 5GP 0.04483 0.41397 5.33981
229 4NVP 7CH 0.02091 0.41252 5.33981
230 2XBN PMP 0.01305 0.41091 5.33981
231 1WL4 COA 0.0387 0.40726 5.33981
232 1RY2 AMP 0.01773 0.40498 5.33981
233 4UAL 3FV 0.01069 0.40305 5.33981
234 1YBH P22 0.03039 0.40069 5.33981
235 3BY8 MLT 0.008574 0.4016 5.6338
236 3T2W BTN 0.001921 0.42514 5.7377
237 4HA6 FAD 0.002719 0.46187 5.82524
238 2YC5 6BC 0.002574 0.45444 5.82524
239 4CS4 AXZ 0.005355 0.448 5.82524
240 4CS4 ANP 0.003978 0.448 5.82524
241 4KCF AKM 0.001917 0.44452 5.82524
242 2CE7 ADP 0.00111 0.44023 5.82524
243 3T31 FAD 0.01607 0.43323 5.82524
244 3T31 DCQ 0.01715 0.43323 5.82524
245 1OAA OAA 0.01175 0.43188 5.82524
246 1KBJ FMN 0.005434 0.42781 5.82524
247 1J5P NAD 0.007257 0.4251 5.82524
248 2H8Z 8CM 0.008805 0.42267 5.82524
249 2H8Z FMN 0.008805 0.42267 5.82524
250 1UXG FUM 0.01623 0.42066 5.82524
251 1UXG NAD 0.01623 0.42066 5.82524
252 1QPB TPP 0.009709 0.41805 5.82524
253 1QPB PYM 0.009709 0.41805 5.82524
254 1A69 FMB 0.0495 0.41302 5.82524
255 1F74 NAY 0.006514 0.41017 5.82524
256 2CKM AA7 0.03263 0.40912 5.82524
257 2XCG XCG 0.01887 0.40897 5.82524
258 2D0V PQQ 0.01209 0.40445 5.82524
259 2I4O ATP 0.007265 0.40129 5.82524
260 2YPO PHE 0.02792 0.40122 5.82524
261 3KJI ADP 0.01104 0.40045 5.82524
262 3CKJ CIT 0.02449 0.40006 5.82524
263 1SS4 CIT 0.00008147 0.56237 5.88235
264 1SS4 GSH 0.004327 0.45614 5.88235
265 4AP9 1PS 0.001919 0.43896 5.97015
266 3DDC GNP 0.02235 0.40048 6.13497
267 2IXB A2G 0.002733 0.45664 6.31068
268 2IXB NAD 0.001783 0.45664 6.31068
269 1EDO NAP 0.01115 0.44874 6.31068
270 1XHL NDP 0.004882 0.4381 6.31068
271 2H6T IVA VAL VAL STA ALA STA 0.001726 0.43679 6.31068
272 3CQD ATP 0.007103 0.43634 6.31068
273 4AAW R84 0.01376 0.43198 6.31068
274 2VJJ RAM GLC GAL NAG NAG GLC 0.01543 0.43077 6.31068
275 4KQI NIO 0.007205 0.42918 6.31068
276 4KQI RBZ 0.007205 0.42918 6.31068
277 4QVH COA 0.006061 0.4279 6.31068
278 3QQA TCH 0.006512 0.41958 6.31068
279 1SB8 UD2 0.02957 0.41894 6.31068
280 4IVG ANP 0.03176 0.416 6.31068
281 2WE5 ADP 0.004914 0.41313 6.31068
282 1SB8 NAD 0.0356 0.41213 6.31068
283 3SSO SAH 0.01034 0.40914 6.31068
284 1NN5 ANP 0.01944 0.40838 6.31068
285 1NN5 2DT 0.01944 0.40838 6.31068
286 1H8G CHT 0.004091 0.44952 6.31579
287 3S2Y FMN 0.002215 0.43428 6.53266
288 3NCQ ATP 0.007544 0.41509 6.72269
289 3EE4 MYR 0.002085 0.43932 6.79612
290 3TN7 NJP 0.008955 0.42489 6.79612
291 2XVE FAD 0.03407 0.42111 6.79612
292 2QA1 FAD 0.01697 0.41672 6.79612
293 3BRE C2E 0.003307 0.41285 6.79612
294 1F8F NAD 0.04462 0.41154 6.79612
295 3MB5 SAM 0.03927 0.41152 6.79612
296 4GLJ RHB 0.02101 0.40918 6.79612
297 4A6D SAM 0.01313 0.40291 6.79612
298 3O03 NAP 0.02144 0.40265 6.79612
299 3FSY SCA 0.03686 0.40253 6.79612
300 3O03 GCO 0.009142 0.4018 6.79612
301 2P1M IHP 0.006398 0.42466 6.875
302 2P1O IHP 0.009476 0.42253 6.875
303 2P1O NLA 0.009476 0.42253 6.875
304 1HFS L04 0.01291 0.41885 6.875
305 4F8L GAL 0.005077 0.44464 6.89655
306 1YAG ATP 0.00317 0.43494 7.2
307 3BW2 FMN 0.001087 0.46493 7.28155
308 2HGZ PBF 0.002949 0.43798 7.28155
309 9LDB NAD 0.004863 0.43692 7.28155
310 9LDT NAD 0.005406 0.43483 7.28155
311 1XX4 BAM 0.003338 0.4348 7.28155
312 1FIQ FAD 0.008468 0.42954 7.28155
313 2ZB3 NDP 0.01067 0.41892 7.28155
314 3F3E LEU 0.01963 0.41582 7.28155
315 2AMV BIN 0.03771 0.41238 7.28155
316 2VAR ANP 0.01045 0.40894 7.28155
317 1FIQ MTE 0.02083 0.40701 7.28155
318 1JIL 485 0.01151 0.40538 7.28155
319 2DDH HXD 0.01461 0.4026 7.28155
320 1FIQ SAL 0.03037 0.40183 7.28155
321 3Q3C NAD 0.008237 0.44581 7.35786
322 2HVW DCP 0.009106 0.40187 7.6087
323 1O6B ADP 0.04972 0.40281 7.69231
324 2ZWS PLM 0.0003053 0.50816 7.76699
325 1OYJ GSH 0.0002106 0.48784 7.76699
326 2PTZ PAH 0.0009153 0.44618 7.76699
327 4EPL JAI 0.001197 0.44125 7.76699
328 3LZW NAP 0.0211 0.42949 7.76699
329 3C1O NAP 0.0054 0.42639 7.76699
330 4CMF PXG 0.02527 0.42082 7.76699
331 3WE0 FAD 0.02981 0.41268 7.76699
332 3LZW FAD 0.02567 0.41134 7.76699
333 1H16 COA 0.0113 0.40573 7.76699
334 3L4N GSH 0.0001466 0.49497 7.87402
335 3EM1 TYD 0.01345 0.40813 8.21918
336 4LWM MHO 0.001614 0.46953 8.25243
337 1LL2 UPG 0.0005221 0.46537 8.25243
338 3MAG 3MA 0.002557 0.44958 8.25243
339 3IOI 1GW 0.005093 0.43727 8.25243
340 1XVV CCQ 0.009572 0.43235 8.25243
341 1HDR NAD 0.01887 0.42618 8.25243
342 4AT0 FAD 0.01916 0.42509 8.25243
343 3VPD ANP 0.008344 0.41319 8.25243
344 3BAZ NAP 0.01178 0.41289 8.25243
345 4LFL TG6 0.003893 0.41248 8.25243
346 2JFV FLC 0.003558 0.41153 8.25243
347 1P9B IMO 0.01223 0.41071 8.25243
348 2XDQ MGX 0.01116 0.41002 8.25243
349 3MCT SAH 0.01135 0.40737 8.25243
350 1P9B GDP 0.009985 0.40432 8.25243
351 1UKW FAD 0.03861 0.40206 8.25243
352 2V5E SCR 0.006454 0.42967 8.5
353 2Q97 ATP 0.006523 0.41955 8.52713
354 3QV1 NAD 0.0279 0.40003 8.53659
355 3RF4 FUN 0.002546 0.40237 8.62069
356 3BL6 FMC 0.00633 0.41473 8.69565
357 2NLI LAC 0.009623 0.44101 8.73786
358 2NLI FMN 0.009623 0.44101 8.73786
359 1Z45 NAD 0.003956 0.43966 8.73786
360 2Q1S NAI 0.01094 0.43335 8.73786
361 4TMK T5A 0.04788 0.43139 8.73786
362 2V6O FAD 0.02847 0.43061 8.73786
363 3OND ADN 0.01604 0.42878 8.73786
364 3OND NAD 0.01604 0.42878 8.73786
365 3LPF Z77 0.01316 0.41215 8.73786
366 3ULK NDP 0.0104 0.41069 8.73786
367 1Z45 UPG 0.009161 0.40784 8.73786
368 3ZOD HQE 0.003131 0.43995 8.90052
369 3ZOD FMN 0.003131 0.43995 8.90052
370 3B96 MYA 0.0009538 0.45204 9.2233
371 1IM8 SAI 0.001494 0.4456 9.2233
372 2C3Q GTX 0.002996 0.44074 9.2233
373 2X61 CH 0.006803 0.43927 9.2233
374 3Q9T FAY 0.007244 0.43698 9.2233
375 4AF0 IMP 0.04122 0.40904 9.2233
376 3TA2 ATP 0.02632 0.40632 9.32203
377 2J07 HDF 0.0343 0.41365 9.52381
378 2J07 FAD 0.0343 0.41365 9.52381
379 1SOW NAD 0.0003144 0.49219 9.70874
380 2J7T 274 0.005869 0.4306 9.70874
381 1M5B BN1 0.02719 0.42343 9.70874
382 2YBQ UP2 0.01953 0.41493 9.70874
383 1MG1 MAL 0.009124 0.41318 9.70874
384 2YBQ SAH 0.0114 0.40557 9.70874
385 2OYS FMN 0.01313 0.40462 9.70874
386 1KWK GAL 0.01356 0.40051 9.70874
387 1F7L COA 0.01438 0.41842 9.91736
388 1QJC PNS 0.01612 0.4321 10.1266
389 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.00455 0.44843 10.1942
390 1TDF FAD 0.008837 0.44034 10.1942
391 1TDF NAP 0.02199 0.43518 10.1942
392 3IO3 ADP 0.0129 0.40144 10.1942
393 1L1Q 9DA 0.005489 0.41928 10.2151
394 3ZRR PXG 0.009564 0.40886 10.6771
395 1H9G COA MYR 0.002587 0.44364 10.6796
396 2IZ1 ATR 0.001604 0.42593 10.6796
397 1PFK ADP 0.003136 0.42359 10.6796
398 2F3R G5P 0.02903 0.41641 10.6796
399 2QCX PF1 0.004339 0.40196 10.6796
400 1WTC ACP 0.00166 0.40109 10.6796
401 2Q37 3AL 0.0004809 0.44022 11.0497
402 2WCI GSH 0.003412 0.42217 11.1111
403 1K0D GSH 0.00005755 0.53538 11.165
404 1QF5 RPL 0.02472 0.41977 11.165
405 1QF5 GDP 0.02472 0.41977 11.165
406 2R00 OEG 0.0005714 0.42119 11.6505
407 3F81 STT 0.01277 0.40724 12.0219
408 4O1M NAD 0.001512 0.45848 12.1359
409 3GX0 GDS 0.00006572 0.41158 12.1359
410 1WUR 8DG 0.01436 0.40455 12.1359
411 3WD1 ST7 0.01492 0.42697 12.6214
412 2R40 EPH 0.01338 0.41635 12.6214
413 4PO2 ASN ARG LEU LEU LEU THR GLY 0.01169 0.40846 12.766
414 1VJT NAD 0.004463 0.42316 13.1068
415 1DLJ NAI 0.003355 0.46293 13.5922
416 3DAG FEG 0.005714 0.42684 13.5922
417 1DLJ UGA 0.03202 0.41583 13.5922
418 1E7S NAP 0.01973 0.41043 13.5922
419 1TU3 GNP 0.02181 0.40097 13.9241
420 2GDZ NAD 0.005033 0.43494 14.0777
421 1R27 MGD 0.007374 0.43452 14.0777
422 3LM9 FRU 0.01842 0.40282 14.0777
423 1YGC 905 0.01094 0.40633 14.2857
424 2P4T NAP 0.01564 0.41388 14.5161
425 1OLS TDP 0.005028 0.45021 14.5631
426 1V9N NDP 0.01241 0.41964 14.5631
427 3GWT 066 0.01684 0.41242 14.5631
428 2YB9 HA0 0.02855 0.40077 14.5631
429 1EP2 ORO 0.007604 0.43169 15.0485
430 1EP2 FMN 0.007404 0.42471 15.0485
431 1EP2 FAD 0.006901 0.42012 15.0485
432 1IUP ALQ 0.02379 0.40439 15.0485
433 1QY1 PRZ 0.009062 0.41163 15.5172
434 4AGS GSH 0.000881 0.44526 15.534
435 3BS8 PMP 0.001669 0.43031 15.534
436 2WIC GNP 0.008258 0.41748 16.0194
437 1T0S BML 0.002704 0.43083 16.2791
438 1B55 4IP 0.008204 0.40378 17.1598
439 1UWZ THU 0.00882 0.40459 18.3824
440 1P9P SAH 0.001305 0.45003 18.4466
441 1EZV SMA 0.01169 0.41446 18.4466
442 4NES UD1 0.01236 0.40225 19.4175
443 4LTN NAI 0.02554 0.41909 19.797
444 4LTN FMN 0.02409 0.41709 19.797
445 1PL6 572 0.03302 0.40123 19.9029
446 3RHC GSH 0.00009125 0.51279 20.354
447 2R14 TXD 0.01923 0.40978 21.3592
448 2R14 FMN 0.01932 0.40468 21.3592
449 2DKH FAD 0.00566 0.43639 21.8447
450 2DKH 3HB 0.01145 0.42872 21.8447
451 4A3R CIT 0.02737 0.4071 21.8447
452 2YVF NAD 0.008133 0.45176 23.301
453 2YVF FAD 0.007881 0.45176 23.301
454 1FW1 GSH 0.0005827 0.4131 23.301
455 3IL6 B83 0.008025 0.41216 24.7573
456 3BK2 U5P 0.00611 0.40685 24.7573
457 4FDV 0UK 0.003386 0.44532 25.2427
458 2JAC GSH 0.0002571 0.48562 26.3636
459 3F6D GTX 0.00001299 0.45613 27.6699
460 1GWC GTX 0.0000572 0.47268 27.8261
461 1JLV GSH 0.00003352 0.53458 28.6408
462 1V2A GTS 0.00003081 0.52826 30.0971
463 2PVQ GSH 0.000504 0.40691 30.3483
464 1N2A GTS 0.002822 0.4456 30.8458
465 2IMI GSH 0.000007756 0.58287 31.068
466 3VWX GSH 0.00003133 0.51187 34.466
467 1GSU GTX 0.000008117 0.48611 34.466
468 3IBH GSH 0.0001011 0.40542 37.3786
469 1PN9 GTX 0.00002396 0.55879 37.8641
470 4IS0 1R4 0.00003 0.56258 38.3495
471 4IS0 GDS 0.0002493 0.50579 38.3495
472 1XW6 GSH 0.000002097 0.44456 38.3495
473 3GST GPR 0.000001201 0.43798 38.3495
474 1B4P GPS 0.000002812 0.47385 38.835
475 1AXD GGL CYW GLY 0.000003703 0.55464 40.7767
476 2C4J GSO 0.000003536 0.45357 40.7767
477 2FHE GSH 0.000003992 0.57004 42.233
478 3O76 GTB 0.0000000002294 0.8174 43.6893
479 2GSR GTS 0.0000000002642 0.71458 43.6893
480 3IE3 GSH 0.0000000008796 0.48241 43.6893
481 3IE3 N11 0.0002184 0.43321 43.6893
482 1TU7 GSH 0.0000000001331 0.65108 46.6019
483 3IK7 BOB 0.00001477 0.4531 47.5728
484 2C80 GTX 0.00000006333 0.40657 48.5437
485 1VF1 GSH 0.000004762 0.46029 49.5146
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