Receptor
PDB id Resolution Class Description Source Keywords
3GTD 2.4 Å EC: 4.2.1.2 2.4 ANGSTROM CRYSTAL STRUCTURE OF FUMARATE HYDRATASE FROM RI PROWAZEKII RICKETTSIA PROWAZEKII STRUCTURAL GENOMICS SSGCID FUMARATE HYDRATASE LYASE TRICARBOXYLIC ACID CYCLE SEATTLE STRUCTURAL GENOMICS CENTEINFECTIOUS DISEASE
Ref.: STRUCTURE OF FUMARATE HYDRATASE FROM RICKETTSIA PRO THE AGENT OF TYPHUS AND SUSPECTED RELATIVE OF THE MITOCHONDRIA. ACTA CRYSTALLOGR.,SECT.F V. 67 1123 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MLI A:462;
B:462;
Valid;
Valid;
none;
none;
submit data
102.046 C3 H2 O4 C(C(=...
NA A:463;
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
3GTD 2.4 Å EC: 4.2.1.2 2.4 ANGSTROM CRYSTAL STRUCTURE OF FUMARATE HYDRATASE FROM RI PROWAZEKII RICKETTSIA PROWAZEKII STRUCTURAL GENOMICS SSGCID FUMARATE HYDRATASE LYASE TRICARBOXYLIC ACID CYCLE SEATTLE STRUCTURAL GENOMICS CENTEINFECTIOUS DISEASE
Ref.: STRUCTURE OF FUMARATE HYDRATASE FROM RICKETTSIA PRO THE AGENT OF TYPHUS AND SUSPECTED RELATIVE OF THE MITOCHONDRIA. ACTA CRYSTALLOGR.,SECT.F V. 67 1123 2011
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 3GTD - MLI C3 H2 O4 C(C(=O)[O-....
70% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 1FUQ - SIF C7 H14 O4 Si C[Si](C)(C....
2 1FUP - PMA C10 H6 O8 c1c(c(cc(c....
3 2FUS - CIT C6 H8 O7 C(C(=O)O)C....
4 1FUR - MLT C4 H6 O5 C([C@H](C(....
5 3GTD - MLI C3 H2 O4 C(C(=O)[O-....
50% Homology Family (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1FUQ - SIF C7 H14 O4 Si C[Si](C)(C....
2 1FUP - PMA C10 H6 O8 c1c(c(cc(c....
3 2FUS - CIT C6 H8 O7 C(C(=O)O)C....
4 1FUR - MLT C4 H6 O5 C([C@H](C(....
5 5F91 Ki = 3.2 uM 5WJ C23 H26 N4 O5 S COc1ccc(cc....
6 4ADM - SRT C4 H6 O6 [C@H]([C@H....
7 4APB - FUM C4 H4 O4 C(=C/C(=O)....
8 4ADL - LMR C4 H6 O5 C([C@@H](C....
9 3GTD - MLI C3 H2 O4 C(C(=O)[O-....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: MLI; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 MLI 1 1
2 OAA 0.5 0.666667
3 SIN 0.5 0.785714
4 OXL 0.416667 0.642857
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3GTD; Ligand: MLI; 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: 3gtd.bio1) has 11 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3GTD; Ligand: MLI; Similar sites found: 629
This union binding pocket(no: 2) in the query (biounit: 3gtd.bio1) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO5 PIH 0.001698 0.46941 None
2 3DNT ATP 0.01631 0.40368 1.13636
3 1N6B DMZ 0.03592 0.40353 1.2685
4 1H82 FAD 0.02571 0.42462 1.27119
5 1H82 GZZ 0.02812 0.42462 1.27119
6 3BW2 FMN 0.01733 0.41064 1.35501
7 4INB 1F6 0.00783 0.41262 1.36986
8 1SAY PYR 0.04765 0.43357 1.38504
9 4R33 TRP 0.01346 0.41918 1.42857
10 4R33 SAH 0.01346 0.41918 1.42857
11 3CXO 1N5 0.0223 0.40685 1.44578
12 3PC3 P1T 0.00129 0.44837 1.45228
13 3T1A 5MA 0.002554 0.43163 1.45228
14 2VJJ RAM GLC GAL NAG NAG GLC 0.02637 0.41955 1.45228
15 2C5S AMP 0.0006973 0.41322 1.45278
16 3NKS FAD 0.02364 0.41205 1.46751
17 4J7H TLO 0.008681 0.41244 1.4862
18 1YWQ FMN 0.005532 0.41317 1.5
19 2I4O ATP 0.003676 0.41351 1.52838
20 1GS5 ANP 0.01753 0.41391 1.55039
21 1GS5 NLG 0.01753 0.41391 1.55039
22 1HXD BTN 0.002531 0.45735 1.55763
23 2G86 UMP 0.02665 0.41896 1.58228
24 1Q11 TYE 0.0006867 0.42394 1.6129
25 1H6C NDP 0.00408 0.44749 1.61663
26 1H6C SIN 0.03379 0.40664 1.61663
27 1ML4 PAL 0.004858 0.42762 1.62338
28 3DG6 MUC 0.001036 0.44149 1.63488
29 1UBY DMA 0.002806 0.42781 1.63488
30 3E4O SIN 0.002147 0.41421 1.63934
31 3QP4 HL0 0.006937 0.40901 1.64835
32 3LM9 FRU 0.00386 0.43282 1.65563
33 3WD1 ST7 0.01514 0.42667 1.65975
34 2J07 FAD 0.0355 0.41293 1.65975
35 2J07 HDF 0.0355 0.41293 1.65975
36 3WKX FUB 0.001731 0.41138 1.65975
37 1XHL NDP 0.001674 0.45922 1.6835
38 1F74 NAY 0.003579 0.42117 1.70648
39 3BK2 U5P 0.006531 0.40564 1.77936
40 1GAD NAD 0.003746 0.43649 1.81818
41 1JA9 NDP 0.003304 0.47491 1.82482
42 1JA9 PYQ 0.01654 0.41032 1.82482
43 1X54 4AD 0.003683 0.43372 1.84332
44 2C4I BTN 0.00322 0.42311 1.84502
45 1D3V ABH 0.01213 0.41233 1.85759
46 1D6H COA 0.005811 0.44633 1.86722
47 3FSJ D7K 0.02424 0.43195 1.86722
48 4IVG ANP 0.02471 0.42129 1.86722
49 1T10 F6P 0.004284 0.40218 1.86722
50 1OTH PAO 0.01706 0.41332 1.86916
51 2NX1 RP5 0.01827 0.40709 1.87266
52 2NX1 PEP 0.02334 0.40229 1.87266
53 1GR0 NAD 0.01311 0.44752 1.90736
54 4UAL 3FV 0.001927 0.43475 1.90931
55 2RCN GDP 0.001058 0.43582 1.95531
56 1DLJ UGA 0.02592 0.42029 1.99005
57 1DLJ NAI 0.02592 0.42029 1.99005
58 3OZG SSI 0.001973 0.4321 2
59 2HW1 ANP 0.0007754 0.45794 2.01342
60 2HW1 FRU 0.002232 0.41353 2.01342
61 3P0F BAU 0.00537 0.41371 2.0202
62 2OI2 DP6 0.005006 0.41045 2.05479
63 2OYS FMN 0.004368 0.4254 2.06612
64 4IOK XPO 0.003212 0.43469 2.07469
65 4IOK ADP 0.00411 0.43469 2.07469
66 4MZ7 DTP 0.007187 0.42795 2.07469
67 4MZ7 DGT 0.02889 0.40054 2.07469
68 2R85 AMP 0.04609 0.40556 2.09581
69 2CE7 ADP 0.001454 0.43531 2.10084
70 4USS GSH 0.004996 0.40254 2.15385
71 1TDF NAP 0.04723 0.41845 2.21519
72 1TDF FAD 0.03658 0.4108 2.21519
73 4USQ FAD 0.002873 0.45106 2.21607
74 1WVG CXY 0.004221 0.4278 2.22841
75 2H8Z FMN 0.02122 0.40542 2.22841
76 2H8Z 8CM 0.02122 0.40542 2.22841
77 1NZY BCA 0.01048 0.41795 2.23048
78 3MTW M3R 0.004033 0.41898 2.23325
79 1EYQ NAR 0.004964 0.40548 2.25225
80 2NXW TPP 0.002357 0.45247 2.28216
81 4KXV TDP DX5 0.006666 0.43866 2.28216
82 2XCG XCG 0.00966 0.42215 2.28216
83 3FC4 EDO 0.02866 0.42029 2.28216
84 1UMP SQA 0.01347 0.4103 2.28216
85 4EPM AMP 0.01232 0.40904 2.28216
86 1R27 MGD 0.03875 0.40103 2.28216
87 1EP2 FMN 0.00736 0.42482 2.29885
88 1EP2 ORO 0.0109 0.42451 2.29885
89 4W6Z 8ID 0.02426 0.41054 2.30548
90 1WGC SIA GAL BGC 0.01315 0.41434 2.33918
91 3MB5 SAM 0.03838 0.41201 2.35294
92 1Z44 NPO 0.0007583 0.48761 2.36686
93 1VPM COA 0.002768 0.43752 2.36686
94 1VDC FAD 0.03056 0.41533 2.4024
95 4NES UD1 0.001119 0.44697 2.40642
96 4NES UDP 0.002841 0.42758 2.40642
97 4U9W COA 0.00669 0.41464 2.41546
98 1FP1 HCC 0.005814 0.41631 2.41935
99 4I71 AGV 0.002965 0.42885 2.42424
100 3CQ5 PMP 0.003608 0.41115 2.43902
101 1C3V NDP 0.01212 0.41892 2.44898
102 1NML CIT 0.003913 0.40684 2.45399
103 1YOE RIB 0.01435 0.4131 2.48447
104 2BNF UTP 0.004457 0.44679 2.48963
105 1GRO ICT 0.008283 0.44168 2.48963
106 3W54 RNB 0.003195 0.42098 2.48963
107 2BNE U5P 0.01407 0.41885 2.48963
108 4WBD ADP 0.001023 0.41304 2.48963
109 2FMD MAN MAN 0.01156 0.4053 2.5
110 3S2Y FMN 0.006346 0.41065 2.51256
111 4HZO COA 0.002 0.41865 2.51572
112 4A6D SAM 0.01379 0.40198 2.54958
113 1SB8 NAD 0.001979 0.47214 2.55682
114 1SB8 UD2 0.002336 0.47214 2.55682
115 1Q7E MET 0.009945 0.41759 2.57009
116 3IBH GSH 0.009534 0.40892 2.57511
117 1RKD RIB 0.0008472 0.47265 2.589
118 1RKD ADP 0.0008472 0.47265 2.589
119 3PLN U5P 0.0004779 0.42932 2.59434
120 1DJ9 KAM 0.002898 0.43831 2.60417
121 2EFJ 37T 0.002788 0.4128 2.60417
122 3M0J OAF 0.005641 0.43399 2.60586
123 3BL6 FMC 0.003611 0.42518 2.6087
124 1I36 NAP 0.01576 0.40433 2.65152
125 2ZJ3 G6P 0.0002218 0.47931 2.66667
126 4B4D FAD 0.01544 0.40154 2.67176
127 1E2S CSN 0.001561 0.43402 2.6971
128 2CKM AA7 0.01027 0.43283 2.6971
129 1U7Z PMT 0.01101 0.42319 2.6971
130 2Q28 TPP 0.01236 0.41195 2.6971
131 1OAA OAA 0.01155 0.43224 2.7027
132 5YAS FAC 0.001553 0.42895 2.72374
133 1WUR 8DG 0.007246 0.41755 2.72727
134 2FWP CIT 0.004079 0.44038 2.73224
135 2FWP ICR 0.01685 0.41687 2.73224
136 2IZ1 ATR 0.006075 0.40185 2.74262
137 4G1V FAD 0.004269 0.43541 2.75689
138 1M7Y PPG 0.007449 0.42725 2.75862
139 1TOI HCI 0.00138 0.45883 2.77778
140 1GVF PGH 0.000553 0.44123 2.7972
141 3QDT A2G GAL 0.003728 0.42453 2.7972
142 2XVE FAD 0.03467 0.42073 2.80172
143 1OWB NAD 0.01309 0.41679 2.8103
144 4TMK T5A 0.03176 0.44079 2.8169
145 1G0N NDP 0.001142 0.47423 2.82686
146 1G0N PHH 0.001727 0.46912 2.82686
147 2ZB3 NDP 0.01899 0.40761 2.83286
148 1JQI FAD 0.01088 0.42671 2.83505
149 1JQI CAA 0.008811 0.41701 2.83505
150 1B9I PXG 0.00988 0.41327 2.83505
151 1LVL FAD 0.03962 0.40677 2.83843
152 1LVL NAD 0.01666 0.40011 2.83843
153 3VPD ANP 0.009894 0.40997 2.84698
154 3LTW HLZ 0.004669 0.40661 2.85714
155 1BDB NAD 0.04802 0.41809 2.88809
156 1O7N IND 0.01071 0.41013 2.89532
157 3A8U PLP 0.01741 0.40391 2.89532
158 1H9A NAP 0.009772 0.42669 2.90456
159 3F3E LEU 0.02482 0.41106 2.90456
160 3NNF AKG 0.0004057 0.4346 2.90698
161 3S7O LBV 0.02858 0.40191 2.91545
162 4JP3 CIT 0.007915 0.40216 2.92887
163 4NTD FAD 0.002193 0.46108 2.94118
164 2G36 TRP 0.00172 0.41806 2.94118
165 1XE7 GUN 0.0005877 0.47038 2.95567
166 2GSD NAD 0.007711 0.43253 2.98507
167 9LDT NAD 0.001005 0.4679 3.01205
168 9LDB NAD 0.001075 0.46658 3.01205
169 3MPI FAD 0.0009614 0.47408 3.02267
170 3MPI GRA 0.01827 0.42982 3.02267
171 3RKR NAP 0.007785 0.40004 3.05344
172 2XK9 XK9 0.006133 0.43597 3.10559
173 3GE7 AFQ 0.004197 0.44232 3.10881
174 4AT0 FAD 0.02618 0.41857 3.11203
175 4RJK PYR 0.02187 0.41147 3.11203
176 3TXO 07U 0.00224 0.42745 3.11615
177 3GM5 CIT 0.001241 0.4151 3.14465
178 4HA6 FAD 0.03909 0.40705 3.14961
179 3HF3 FMN 0.007097 0.41795 3.15186
180 2WQP WQP 0.02436 0.40016 3.15186
181 1GSA ADP 0.009282 0.44015 3.16456
182 1GSA GSH 0.0204 0.41879 3.16456
183 1A8R GTP 0.003932 0.42553 3.16742
184 1R37 NAD 0.01529 0.41774 3.17003
185 1XVV CCQ 0.009712 0.43205 3.18627
186 1YAG ATP 0.01078 0.4116 3.2
187 4M2K PLP 0.002313 0.41904 3.20197
188 3T31 FAD 0.002661 0.47102 3.20366
189 3T31 DCQ 0.002864 0.47102 3.20366
190 3M6W SAM 0.002255 0.42964 3.23276
191 1IYE PGU 0.01476 0.41502 3.23625
192 2OD9 A1R NCA 0.006818 0.42899 3.24675
193 3V1U NAD 0.005132 0.42891 3.24675
194 3V1U HXC 0.001585 0.42858 3.24675
195 2QQF A1R 0.01249 0.41176 3.24675
196 1RM4 NDP 0.005638 0.42858 3.2641
197 1IM8 SAI 0.005038 0.4227 3.27869
198 3FXU TSU 0.0206 0.40066 3.27869
199 1KGQ NPI 0.04213 0.42225 3.28467
200 2Q8M FBP 0.007032 0.40876 3.31325
201 2Q8M AMP 0.006535 0.40563 3.31325
202 3ACC 5GP 0.006384 0.401 3.31492
203 3FC2 IBI 0.0005557 0.47806 3.3195
204 2NVK FAD 0.004758 0.44851 3.3195
205 4C12 ADP 0.01544 0.43263 3.3195
206 4C12 UML 0.01406 0.41476 3.3195
207 4EPL JAI 0.009563 0.4031 3.3195
208 4CKU P2F 0.006376 0.44794 3.34347
209 1QS8 IVA VAL VAL STA ALA STA 0.003341 0.43223 3.34347
210 2GDZ NAD 0.004126 0.43883 3.37079
211 3E5H GNP 0.008231 0.41831 3.37079
212 1UOU CMU 0.00862 0.40287 3.37553
213 3W2W ATP 0.0004776 0.4529 3.41615
214 3IL6 B83 0.01008 0.40787 3.42679
215 2YHW BM3 0.005235 0.43417 3.49854
216 2Z9C FMN 0.002619 0.43314 3.5
217 2Z9C DTC 0.00432 0.43223 3.5
218 4GYW UDP 0.005266 0.4366 3.52697
219 4FWE FAD 0.01307 0.4297 3.52697
220 1TRD PGH 0.002189 0.4254 3.52697
221 4AIG FLX 0.002348 0.42154 3.52697
222 3PVT 3HC 0.01383 0.4229 3.53698
223 2WSB NAD 0.04775 0.4107 3.54331
224 3JDW ORN 0.0005523 0.45544 3.5461
225 4QN7 G39 0.03646 0.40129 3.58974
226 3VTF UPG 0.00916 0.40967 3.6036
227 3WBF NAP 0.01749 0.40922 3.60656
228 3WBF API 0.02217 0.40922 3.60656
229 1VQ2 DDN 0.003622 0.42309 3.62694
230 1LYX PGA 0.002135 0.42832 3.62903
231 1PEA ACM 0.005815 0.41581 3.63636
232 1T0S BML 0.01094 0.40338 3.63636
233 2J7T 274 0.006181 0.42959 3.64238
234 1RRC ADP 0.002448 0.43812 3.65448
235 2ZYF AKG 0.002936 0.41481 3.66492
236 2V7T SAH 0.004292 0.47825 3.67893
237 4AF5 CIT 0.001067 0.41892 3.68421
238 1Q3Q ANP 0.01733 0.43302 3.73444
239 1NW5 SAM 0.004852 0.42159 3.76176
240 3GJB AKG 0.005673 0.40311 3.76176
241 2JFV FLC 0.001078 0.43311 3.78007
242 3K3K A8S 0.008539 0.41099 3.79147
243 1MDZ DCS 0.01792 0.41347 3.81679
244 1MDZ PLP 0.01743 0.4129 3.81679
245 1N1G BCP 0.004237 0.4445 3.82514
246 3HZS M0E 0.04284 0.40348 3.82775
247 2IXB A2G 0.02138 0.41506 3.82883
248 2IXB NAD 0.01473 0.41506 3.82883
249 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.03775 0.412 3.84615
250 1R0X ATP 0.02902 0.40382 3.84615
251 2HXT EHM 0.005389 0.41145 3.85488
252 2WR8 SAH 0.004506 0.44327 3.861
253 3EFS BTN 0.006812 0.43208 3.86266
254 1MK1 APR 0.01626 0.40218 3.86473
255 2PWY SAH 0.001065 0.4557 3.87597
256 1F5F DHT 0.001908 0.43494 3.90244
257 1I0Z OXM 0.01246 0.40775 3.9039
258 2F01 BTQ 0.01626 0.43884 3.93701
259 2F01 BTN 0.01626 0.43884 3.93701
260 2RGH FAD 0.01026 0.43191 3.94191
261 1ZK7 FAD 0.02094 0.42165 3.94191
262 1FL2 FAD 0.01817 0.42026 3.94191
263 2QF7 AGS 0.01266 0.4129 3.94191
264 1ITZ TPP 0.01143 0.41048 3.94191
265 1ZFJ IMP 0.03904 0.40707 3.94191
266 4UBP HAE 0.01315 0.40375 3.96825
267 1WXI AMP 0.02485 0.41294 4
268 4W97 UCA 0.01313 0.40935 4
269 2ZE3 AKG 0.003401 0.4062 4
270 2PUL ACP 0.002848 0.42536 4.03023
271 3TKA SAM 0.001709 0.44306 4.03458
272 4DVE BTN 0.0008723 0.43928 4.0404
273 3B96 MYA 0.003538 0.42751 4.08859
274 3B96 FAD 0.01879 0.41671 4.08859
275 4QDC ASD 0.00203 0.44909 4.10256
276 3MMR ABH 0.004123 0.43313 4.11622
277 4MP8 NAD 0.02816 0.4085 4.12979
278 4MP8 MLI 0.02816 0.4085 4.12979
279 4F8L GAL 0.00224 0.46314 4.13793
280 2DVZ GLU 0.003246 0.41574 4.14013
281 1REO FAD 0.002161 0.46247 4.14938
282 2AQJ TRP 0.0145 0.43747 4.14938
283 2AQJ FAD 0.01496 0.43747 4.14938
284 4AF0 IMP 0.01375 0.432 4.14938
285 1H16 PYR 0.0008041 0.40489 4.14938
286 4KQL 1SG 0.01245 0.44269 4.16667
287 4I9A NCN 0.00394 0.43837 4.16667
288 2Q8H TF4 0.005613 0.42414 4.1769
289 1BUC CAA 0.003497 0.43472 4.17755
290 1BUC FAD 0.008004 0.43179 4.17755
291 1H2B NAJ 0.002744 0.45074 4.17827
292 4KCF FMN 0.01167 0.42633 4.18502
293 4KCF AKM 0.009537 0.41394 4.18502
294 4N02 FNR 0.02752 0.42046 4.20168
295 4KQI RBZ 0.007476 0.42845 4.21348
296 4KQI NIO 0.007476 0.42845 4.21348
297 1KOL NAD 0.02328 0.41138 4.27136
298 2Y6P CTP 0.002893 0.4178 4.2735
299 2XVF FAD 0.03159 0.40616 4.31034
300 3UH0 TSB 0.0009854 0.45718 4.34783
301 3CEV ARG 0.003519 0.41159 4.34783
302 2B4Q NAP 0.02849 0.40082 4.34783
303 4AMV F6R 0.0001547 0.47877 4.35685
304 2V6O FAD 0.01228 0.44894 4.35685
305 1PFK ADP 0.007667 0.40717 4.375
306 1Z45 NAD 0.001583 0.45759 4.43491
307 3UXL CFI 0.008559 0.43655 4.43864
308 3I51 6PL 0.007159 0.4225 4.44444
309 3I51 45C 0.008014 0.40193 4.44444
310 1I2B UPG 0.01983 0.42879 4.45545
311 1I2B USQ 0.01983 0.42879 4.45545
312 1I2B NAD 0.01983 0.42879 4.45545
313 4LNL PLG 0.006015 0.40944 4.5045
314 1KDK DHT 0.00114 0.45259 4.51977
315 1JIL 485 0.01401 0.40168 4.52381
316 1P9B HDA 0.001171 0.42475 4.52489
317 1UXG NAD 0.04298 0.40079 4.53074
318 1UXG FUM 0.04298 0.40079 4.53074
319 1G6O ADP 0.02049 0.42809 4.54545
320 2FPU HSO 0.001903 0.40171 4.54545
321 3CKJ CIT 0.007328 0.4235 4.55927
322 1M5B BN1 0.003545 0.46653 4.56274
323 1QPB PYM 0.002366 0.44537 4.56432
324 1QPB TPP 0.002366 0.44537 4.56432
325 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.005709 0.44382 4.56432
326 3Q9T FAY 0.009596 0.4313 4.56432
327 2QA1 FAD 0.01508 0.41909 4.56432
328 1YBH FAD 0.01917 0.41823 4.56432
329 1LCP PLU 0.01696 0.40584 4.56432
330 4LTN FMN 0.01741 0.42379 4.56853
331 4LTN NAI 0.02039 0.42379 4.56853
332 1TB4 PEJ 0.005352 0.43373 4.58221
333 2PY4 DUP 0.03373 0.40712 4.5977
334 1MOQ GLP 0.00007694 0.49671 4.61957
335 2QLX RM4 0.004519 0.41367 4.62963
336 4F2Q QUS 0.004971 0.41292 4.65116
337 4M5P MLA 0.005494 0.43314 4.6683
338 3TN7 NJP 0.0009329 0.46936 4.66926
339 1LC8 33P 0.01866 0.40536 4.67033
340 1QCA FUA 0.01575 0.41314 4.69484
341 1LTH NAD 0.006995 0.45361 4.70219
342 1J5P NAD 0.007801 0.42369 4.74308
343 1UKW FAD 0.007521 0.43519 4.74934
344 1CTU ZEB 0.008144 0.4081 4.7619
345 2ZWS PLM 0.02216 0.41117 4.77178
346 1YS4 NAP 0.01592 0.40258 4.80226
347 1DSS NAD 0.01061 0.41491 4.8048
348 2YC5 6BC 0.01916 0.41428 4.82456
349 2HMT NAI 0.01706 0.4275 4.86111
350 2HGZ PBF 0.001861 0.44678 4.90196
351 1WNG SAH 0.00619 0.41703 4.90566
352 3T2W BTN 0.005646 0.40581 4.91803
353 4M37 SAH 0.009876 0.40826 4.95627
354 2BKA NDP 0.006009 0.43014 4.95868
355 2ZSC BTN 0.006133 0.40909 4.96454
356 2BJK NAD 0.02498 0.42286 4.97925
357 2HFK E4H 0.003004 0.41149 5.01567
358 3PNL ADP 0.01219 0.40767 5.04202
359 4BT5 23B 0.002083 0.4209 5.05837
360 3RK0 AMP 0.004754 0.41138 5.06329
361 1HYE NAP 0.01315 0.4078 5.11182
362 3WE0 FAD 0.01667 0.42469 5.18672
363 1KC7 PPR 0.0008843 0.41087 5.18672
364 1A27 NAP 0.004772 0.43598 5.19031
365 1A27 EST 0.009471 0.40328 5.19031
366 3KYF 5GP 5GP 0.001776 0.42654 5.19481
367 2H6B 3C4 0.02235 0.42625 5.2
368 2YK7 CSF 0.005295 0.41995 5.21472
369 1SS4 GSH 0.002656 0.46595 5.22876
370 2C7G ODP 0.004623 0.45943 5.26316
371 2C7G FAD 0.004792 0.45943 5.26316
372 2WGC SIA GAL BGC 0.004589 0.44692 5.26316
373 2AEB ABH 0.01676 0.41537 5.2795
374 2H6T IVA VAL VAL STA ALA STA 0.001709 0.43697 5.29412
375 1TUF AZ1 0.01075 0.41319 5.29954
376 2DTX BMA 0.004664 0.44691 5.30303
377 2WK1 SAH 0.01188 0.4065 5.31915
378 1XLI GLT 0.008894 0.42742 5.32995
379 2W24 LYS 0.02698 0.40069 5.33333
380 2NS1 ADP 0.01142 0.42302 5.33981
381 1SG4 CO8 0.001971 0.4489 5.38462
382 3A2Q ACA ACA 0.002274 0.43169 5.39419
383 2PNZ UDP 0.007176 0.42245 5.41516
384 1O68 KIV 0.002721 0.41323 5.45455
385 1CKN GTP 0.006521 0.40063 5.45455
386 1C0I FAD 0.02346 0.41929 5.50964
387 1C0I BE2 0.02346 0.41929 5.50964
388 2C1Q BTN 0.02262 0.41485 5.55556
389 4LFL TG6 0.00744 0.40086 5.55556
390 1QF5 GDP 0.02056 0.42362 5.56845
391 1QF5 RPL 0.02056 0.42362 5.56845
392 2P41 SAH 0.004911 0.41946 5.57377
393 1FDJ 2FP 0.004095 0.41409 5.60166
394 2YYJ 4HP 0.008893 0.45919 5.61331
395 2YYJ FAD 0.008893 0.45919 5.61331
396 2DTJ THR 0.001166 0.43409 5.61798
397 2P1O IHP 0.003183 0.44392 5.625
398 2P1O NLA 0.003183 0.44392 5.625
399 2P1M IHP 0.005922 0.42615 5.625
400 1KYV RBF 0.002731 0.42831 5.66038
401 3RGG AIR 0.002594 0.41976 5.66038
402 2FFC U5P 0.01108 0.40428 5.66572
403 1IUP ALQ 0.02497 0.40343 5.67376
404 2HGS GSH 0.003519 0.41921 5.6962
405 1O9U ADZ 0.0009599 0.46033 5.71429
406 1Y9Q MED 0.003759 0.41054 5.72917
407 1KHT AMP 0.005778 0.40278 5.72917
408 1PR9 NAP 0.0006767 0.47845 5.7377
409 1EDO NAP 0.003988 0.47087 5.7377
410 3D3W NAP 0.003207 0.4451 5.7377
411 1HDR NAD 0.01418 0.43214 5.7377
412 4FDV 0UK 0.01124 0.4216 5.74163
413 4IU0 ABH 0.0161 0.40237 5.75758
414 2DWU DGL 0.002883 0.41513 5.7971
415 1HEX NAD 0.02455 0.4013 5.7971
416 2DDH FAD 0.008995 0.4272 5.80913
417 4K5S FAD 0.009152 0.42685 5.80913
418 4K5S PM0 0.01997 0.425 5.80913
419 3SQG TP7 0.009674 0.40289 5.80913
420 1T57 FMN 0.008503 0.41452 5.82524
421 1KBJ FMN 0.01855 0.40411 5.82524
422 3DAG FEG 0.002378 0.44371 5.86592
423 2XDQ MGX 0.008372 0.41593 5.86957
424 2V5E SCR 0.007948 0.42519 5.94059
425 1CBF SAH 0.008374 0.40555 5.96491
426 1GZW GAL BGC 0.009423 0.40341 5.97015
427 2QS8 MET 0.002903 0.44433 5.98086
428 1P72 ADP 0.008563 0.42577 5.98802
429 3RO7 TDR 0.01265 0.41426 6.03774
430 3MCT SAH 0.01202 0.40629 6.06061
431 1I9G SAM 0.0212 0.42139 6.07143
432 1SBZ FMN 0.001859 0.45715 6.09137
433 4C25 13P 0.01901 0.40759 6.13208
434 2YBQ UP2 0.006072 0.43842 6.16438
435 2YBQ SAH 0.002238 0.43608 6.16438
436 1UJ5 5RP 0.001943 0.42756 6.1674
437 4A8H PUW 0.005318 0.43451 6.19718
438 2X61 CH 0.02942 0.40948 6.20155
439 4WNB 4BN 0.008474 0.40736 6.20155
440 4G87 UD1 0.004567 0.45353 6.22407
441 3IU9 T07 0.01248 0.44065 6.25
442 1I1Q TRP 0.00142 0.42771 6.25
443 4OZJ ADP 0.01717 0.40959 6.29371
444 1QY1 PRZ 0.005025 0.42275 6.32184
445 2F59 INI 0.001966 0.43649 6.36943
446 3U4C NDP 0.002811 0.44496 6.40569
447 1TIW TFB 0.01013 0.43021 6.43154
448 1TIW FAD 0.01013 0.43021 6.43154
449 3AHC TPP 0.006763 0.42915 6.43154
450 4O8A FAD 0.007749 0.42774 6.43154
451 3JYN NDP 0.002928 0.44946 6.46154
452 1I7L ATP 0.01884 0.40091 6.47249
453 1RZM E4P 0.002852 0.42233 6.50888
454 1P9P SAH 0.001961 0.44232 6.51341
455 1R6W 164 0.009735 0.40277 6.52174
456 2E2R 2OH 0.004048 0.44424 6.55738
457 1S2D ADE 0.002677 0.4242 6.58683
458 3R35 4CO 0.01619 0.41319 6.62252
459 2Q1S NAI 0.03056 0.41216 6.6313
460 4O1M NAD 0.01761 0.41033 6.66667
461 3OND ADN 0.01561 0.42936 6.7623
462 3OND NAD 0.01561 0.42936 6.7623
463 2VPR TDC 0.003609 0.42102 6.76329
464 2W1A TSA 0.001683 0.4275 6.77966
465 1NHZ 486 0.001976 0.44218 6.78571
466 3CQD ATP 0.003133 0.4528 6.79612
467 1QS0 TDP 0.01458 0.40093 6.80473
468 4HVK PMP 0.004566 0.40697 6.80628
469 3BS8 PMP 0.002627 0.42211 6.84932
470 2EJU SAH 0.005133 0.41864 6.87831
471 1UZN NAP 0.008792 0.40465 6.88259
472 1QH9 LAC 0.002608 0.40385 6.89655
473 2YPO PHE 0.002657 0.44746 6.92641
474 3LZW FAD 0.005034 0.44433 6.92771
475 3LZW NAP 0.01049 0.44433 6.92771
476 1ZUW DGL 0.003503 0.41167 6.98529
477 1B8U OAA 0.02087 0.40931 6.99088
478 4DQ2 BTX 0.004831 0.45501 7.0122
479 3MD0 GDP 0.0053 0.40431 7.04225
480 4E13 NAD 0.01246 0.40561 7.06714
481 3F81 STT 0.0067 0.42051 7.10383
482 1Z6K OAA 0.001006 0.4381 7.16724
483 1V2X SAM 0.001422 0.44456 7.2165
484 1NVV GNP 0.0001991 0.49137 7.22892
485 3DDC GNP 0.01519 0.40798 7.22892
486 4E1N TQX 0.0146 0.40423 7.22892
487 4ARF IP8 GLY PRO ALA 0.01025 0.40183 7.26141
488 4Q3R XA2 0.02154 0.4012 7.27273
489 1ULE GLA GAL NAG 0.009084 0.40704 7.33333
490 4JK3 NAD 0.001181 0.46187 7.33591
491 2WE5 ADP 0.007099 0.40642 7.41935
492 3ICC NAP 0.00959 0.42475 7.45098
493 1POC GEL 0.006692 0.41173 7.46269
494 1HFS L04 0.01863 0.41157 7.5
495 4G10 GSH 0.008712 0.40482 7.54717
496 2PTZ PAH 0.001834 0.43344 7.63889
497 2RHW C0E 0.01157 0.44425 7.77385
498 3ZOD HQE 0.002696 0.44284 7.8534
499 3ZOD FMN 0.002696 0.44284 7.8534
500 1LSS NAD 0.003505 0.42954 7.85714
501 2IMP NAI 0.02703 0.43379 7.88382
502 2IMP LAC 0.003705 0.42664 7.88382
503 3O03 NAP 0.04726 0.41159 7.90378
504 2HJ3 FAD 0.01137 0.40734 8
505 1C1L GAL BGC 0.00796 0.40301 8.0292
506 1L2T ATP 0.01618 0.40382 8.08511
507 3P7I P7I 0.001412 0.41105 8.09969
508 1PL6 572 0.01792 0.41348 8.14607
509 1PL6 NAD 0.01608 0.40239 8.14607
510 4KGM ATP 0.00005083 0.49334 8.16327
511 3UEC ALA ARG TPO LYS 0.004029 0.41583 8.21918
512 3V91 UPG 0.03965 0.40986 8.24742
513 1YGC 905 0.01236 0.40404 8.26772
514 2CFA FAD 0.01586 0.40266 8.29493
515 1JYQ MAZ PTR PTM ASN 0.02117 0.42453 8.33333
516 1C4U IH1 0.004846 0.42067 8.33333
517 2GJ3 FAD 0.01541 0.41357 8.33333
518 4QDF 30Q 0.004169 0.43515 8.37563
519 4CS4 AXZ 0.03369 0.41014 8.39416
520 4CS4 ANP 0.02598 0.41014 8.39416
521 2XBN PMP 0.01562 0.40743 8.43091
522 3PJU C2E 0.01099 0.41564 8.43373
523 2EWM NAD 0.02378 0.40557 8.43373
524 1E4E PHY 0.001422 0.4381 8.45481
525 1X1T NAD 0.01012 0.45201 8.46154
526 1ECC PCP 0.002659 0.43829 8.50622
527 2EB5 OXL 0.002918 0.41511 8.61423
528 1FMB HYB 0.001828 0.42866 8.65385
529 1FIQ FAD 0.02147 0.41094 8.6758
530 1FIQ MTE 0.01816 0.40972 8.6758
531 1FIQ SAL 0.02045 0.40972 8.6758
532 1G8S MET 0.004836 0.40598 8.69565
533 2PT9 2MH 0.006592 0.43453 8.72274
534 2PT9 S4M 0.00516 0.42881 8.72274
535 3CL7 HYN 0.01306 0.40944 8.76623
536 1OLS TDP 0.0381 0.40839 8.77193
537 1QRD FAD 0.01151 0.41034 8.79121
538 3QQA TCH 0.00794 0.41582 8.7963
539 2XBP ATP 0.01211 0.4334 8.84956
540 1RYI FAD 0.02283 0.41648 8.90052
541 1RYI GOA 0.0419 0.4056 8.90052
542 4CO3 ATP 0.006423 0.44381 8.92857
543 4PLG OXM 0.02918 0.40778 8.98204
544 4PLG NAI 0.02918 0.40778 8.98204
545 3ZEI AWH 0.02331 0.40358 9.03226
546 2GGH NLQ 0.01883 0.41463 9.06667
547 2NZU BG6 0.005462 0.40097 9.09091
548 3GEG NAD 0.01671 0.40883 9.12863
549 3FPZ AHZ 0.03343 0.4291 9.20245
550 4NAT 2W5 0.01921 0.41626 9.375
551 2R40 20E 0.0128 0.40982 9.5057
552 2R40 EPH 0.02033 0.4081 9.5057
553 4G28 0W8 0.00156 0.42604 9.80392
554 2GNK ATP 0.01715 0.41146 9.82143
555 1O6B ADP 0.04975 0.4028 10.0592
556 3KJI ADP 0.003121 0.42368 10.2362
557 1T26 NAI 0.03501 0.43349 10.2484
558 1T26 GBD 0.03501 0.43349 10.2484
559 1Y52 BTN 0.0237 0.41571 10.3175
560 1V35 NAI 0.0194 0.41982 10.3343
561 4BCS BTN 0.00767 0.40716 10.4
562 3ZRR PXG 0.00132 0.44596 10.4167
563 2CSN CKI 0.0009673 0.461 10.4377
564 4IAE 1DX 0.0353 0.41342 10.582
565 1RYD GLC 0.001941 0.40864 10.5943
566 1RYD NDP 0.03961 0.40154 10.5943
567 1UAY ADN 0.003674 0.41843 10.7438
568 1L1Q 9DA 0.01258 0.40371 10.7527
569 2UZ2 BTN 0.004913 0.41535 10.7692
570 3DX5 DHB 0.004979 0.40807 10.8392
571 4BMO FMN 0.008804 0.41851 10.9244
572 2Q2V NAD 0.005999 0.43278 10.9804
573 3S9K CIT 0.0001197 0.55038 11.0169
574 4PO2 ASN ARG LEU LEU LEU THR GLY 0.002224 0.43994 11.0638
575 2D0V PQQ 0.005135 0.42053 11.1111
576 1WVC CTP 0.005379 0.47124 11.1969
577 2P8O BVA 0.002389 0.43078 11.3402
578 1DKU AP2 0.0159 0.40914 11.3565
579 1FW1 GSH 0.0002227 0.40077 11.5741
580 1UWZ THU 0.001522 0.43686 11.7647
581 2AMV BIN 0.01249 0.43557 11.8257
582 1S8F GDP 0.01686 0.40734 11.8644
583 2WCV FUC 0.005283 0.407 12.1429
584 2D2I NAP 0.002761 0.43924 12.3684
585 2HNK SAH 0.007625 0.41312 12.5523
586 3SJ7 NDP 0.0125 0.41582 12.6984
587 2AC7 ADN 0.04908 0.40066 12.766
588 1ECM TSA 0.001423 0.40335 12.844
589 3UIE ANP 0.003067 0.41676 13
590 2ALG HP6 0.000316 0.47482 13.0435
591 2ALG DAO 0.000316 0.47482 13.0435
592 1NME 159 0.0003746 0.40487 13.0435
593 3RFV 15L 0.02036 0.40366 13.1086
594 4NPT 017 0.003583 0.41397 13.1313
595 3TCT 3MI 0.04318 0.4109 13.3858
596 1T8U UAP SGN IDS SGN 0.006859 0.43809 13.9706
597 1BTN I3P 0.0002079 0.5248 14.1509
598 3B20 NAD 0.003106 0.43857 14.1593
599 1NXJ TLA 0.0009634 0.44641 14.2077
600 4LIT AKG 0.004633 0.40082 14.2506
601 2VAR KDG 0.002655 0.42192 14.377
602 2VAR ANP 0.006772 0.41713 14.377
603 1TU3 GNP 0.003252 0.43769 14.6199
604 1Q6O LG6 0.002314 0.42917 14.8148
605 4QED NAP 0.01453 0.41412 14.9194
606 4GO7 THR 0.001395 0.43087 15
607 2AE2 PTO 0.04677 0.40081 15
608 2AE2 NAP 0.04677 0.40081 15
609 3PMD 11A 0.00261 0.41965 15.0327
610 3QVL 5HY 0.04273 0.41043 15.102
611 4BI7 PGA 0.0008899 0.436 15.1751
612 2QXX TTP 0.03103 0.40604 15.2632
613 1NN5 ANP 0.02131 0.40657 16.7442
614 1NN5 2DT 0.02131 0.40657 16.7442
615 3NCQ ATP 0.005276 0.42184 16.8067
616 2PTR 2SA 0.008797 0.43491 16.8831
617 1CSI OAA 0.005425 0.44385 17.7011
618 1CSI CMX 0.005425 0.44385 17.7011
619 1R6D DAU 0.03087 0.41803 18.6944
620 1R6D NAD 0.03189 0.41803 18.6944
621 1EZV SMA 0.002773 0.4423 19.6262
622 2E1A MSE 0.0001741 0.43356 20
623 4MOB COA 0.02167 0.41479 20.1807
624 3TA2 AKG 0.02236 0.40439 20.339
625 3TA2 ATP 0.03468 0.40077 20.339
626 2HV8 GTP 0.02068 0.40058 23.4375
627 1UJ2 C5P 0.01108 0.41407 25.7937
628 3KMZ EQO 0.006862 0.42477 31.5789
629 3ZZS TRP 0.02153 0.41193 43.0769
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