Receptor
PDB id Resolution Class Description Source Keywords
3D6V 2.2 Å EC: 6.1.1.1 CRYSTAL STRUCTURE OF 4-(TRIFLUOROMETHYLDIAZIRINYL) PHENYLALANYL-TRNA SYNTHETASE METHANOCALDOCOCCUS JANNASCHII PHOTOCROSSLINKING UNNATURAL AMINO ACID AMINOACYL-TRNA SYNTHETASE ATP-BINDING CYTOPLASM LIGASE NUCLEOTIDE- BINDING PROTEIN BIOSYNTHESIS
Ref.: A GENETICALLY ENCODED DIAZIRINE PHOTOCROSSLINKER IN ESCHERICHIA COLI CHEMBIOCHEM V. 8 2210 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BME A:401;
Invalid;
none;
submit data
78.133 C2 H6 O S C(CS)...
TFQ A:400;
Valid;
none;
submit data
247.214 C11 H12 F3 N O2 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2HGZ 2.5 Å EC: 6.1.1.1 CRYSTAL STRUCTURE OF A P-BENZOYL-L-PHENYLALANYL-TRNA SYNTHET METHANOCALDOCOCCUS JANNASCHII P-BENZOYL-L-PHENYLALANINE UNNATURAL AMINO ACID AMINOACYL-TSYNTHETASE LIGASE
Ref.: STRUCTURAL BASIS FOR THE RECOGNITION OF PARA-BENZOYL-L-PHENYLALANINE BY EVOLVED AMINOACYL-T SYNTHETASES. ANGEW.CHEM.INT.ED.ENGL. V. 46 6073 2007
Members (15)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 12 families.
1 4NX2 - 2LT C9 H9 Cl2 N O3 c1c(cc(c(c....
2 3QE4 - 4CF C10 H10 N2 O2 c1cc(ccc1C....
3 4NDA - NIY C9 H10 N2 O5 c1cc(c(cc1....
4 3D6V - TFQ C11 H12 F3 N O2 c1cc(ccc1C....
5 2AG6 - 4BF C9 H10 Br N O2 c1cc(ccc1C....
6 3D6U - T11 C11 H12 F3 N3 O2 c1cc(ccc1C....
7 4PBT - 2LQ C18 H24 N2 O3 c1cc(ccc1C....
8 2HGZ - PBF C16 H15 N O3 c1ccc(cc1)....
9 4PBR - 2L7 C13 H17 Br N2 O3 CC(C)(C(=O....
10 5L7P - BUU C16 H16 N2 O6 c1ccc(c(c1....
11 2PXH - BP5 C13 H13 N3 O2 c1ccnc(c1)....
12 3N2Y - TEF C10 H11 N5 O2 c1cc(ccc1C....
13 1ZH6 - 4AF C11 H13 N O3 CC(=O)c1cc....
14 4PBS - 2L7 C13 H17 Br N2 O3 CC(C)(C(=O....
15 1ZH0 - NAL C13 H13 N O2 c1ccc2cc(c....
70% Homology Family (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 10 families.
1 2CYB - TYR C9 H11 N O3 c1cc(ccc1C....
2 4NX2 - 2LT C9 H9 Cl2 N O3 c1c(cc(c(c....
3 3QE4 - 4CF C10 H10 N2 O2 c1cc(ccc1C....
4 4NDA - NIY C9 H10 N2 O5 c1cc(c(cc1....
5 3D6V - TFQ C11 H12 F3 N O2 c1cc(ccc1C....
6 2AG6 - 4BF C9 H10 Br N O2 c1cc(ccc1C....
7 3D6U - T11 C11 H12 F3 N3 O2 c1cc(ccc1C....
8 4PBT - 2LQ C18 H24 N2 O3 c1cc(ccc1C....
9 2HGZ - PBF C16 H15 N O3 c1ccc(cc1)....
10 4PBR - 2L7 C13 H17 Br N2 O3 CC(C)(C(=O....
11 5L7P - BUU C16 H16 N2 O6 c1ccc(c(c1....
12 2PXH - BP5 C13 H13 N3 O2 c1ccnc(c1)....
13 3N2Y - TEF C10 H11 N5 O2 c1cc(ccc1C....
14 1ZH6 - 4AF C11 H13 N O3 CC(=O)c1cc....
15 4PBS - 2L7 C13 H17 Br N2 O3 CC(C)(C(=O....
16 1ZH0 - NAL C13 H13 N O2 c1ccc2cc(c....
50% Homology Family (21)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 2CYB - TYR C9 H11 N O3 c1cc(ccc1C....
2 4NX2 - 2LT C9 H9 Cl2 N O3 c1c(cc(c(c....
3 3QE4 - 4CF C10 H10 N2 O2 c1cc(ccc1C....
4 4NDA - NIY C9 H10 N2 O5 c1cc(c(cc1....
5 3D6V - TFQ C11 H12 F3 N O2 c1cc(ccc1C....
6 2AG6 - 4BF C9 H10 Br N O2 c1cc(ccc1C....
7 3D6U - T11 C11 H12 F3 N3 O2 c1cc(ccc1C....
8 4PBT - 2LQ C18 H24 N2 O3 c1cc(ccc1C....
9 2HGZ - PBF C16 H15 N O3 c1ccc(cc1)....
10 4PBR - 2L7 C13 H17 Br N2 O3 CC(C)(C(=O....
11 5L7P - BUU C16 H16 N2 O6 c1ccc(c(c1....
12 2PXH - BP5 C13 H13 N3 O2 c1ccnc(c1)....
13 3N2Y - TEF C10 H11 N5 O2 c1cc(ccc1C....
14 1ZH6 - 4AF C11 H13 N O3 CC(=O)c1cc....
15 4PBS - 2L7 C13 H17 Br N2 O3 CC(C)(C(=O....
16 1ZH0 - NAL C13 H13 N O2 c1ccc2cc(c....
17 2CYC - TYR C9 H11 N O3 c1cc(ccc1C....
18 1Q11 - TYE C9 H13 N O2 c1cc(ccc1C....
19 5THH - TYR C9 H11 N O3 c1cc(ccc1C....
20 3VGJ - YAP C19 H23 N6 O9 P c1cc(ccc1C....
21 2J5B - TYE C9 H13 N O2 c1cc(ccc1C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: TFQ; Similar ligands found: 14
No: Ligand ECFP6 Tc MDL keys Tc
1 TFQ 1 1
2 PFF 0.619048 0.833333
3 DTY 0.595238 0.666667
4 TYR 0.595238 0.666667
5 4BF 0.545455 0.774194
6 PHI 0.545455 0.774194
7 T11 0.54 0.622222
8 0A1 0.521739 0.611111
9 4AF 0.521739 0.6875
10 4CF 0.510638 0.709677
11 DPN 0.5 0.785714
12 PHE 0.5 0.785714
13 PBF 0.45283 0.666667
14 DAH 0.42 0.621622
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2HGZ; Ligand: PBF; Similar sites found: 598
This union binding pocket(no: 1) in the query (biounit: 2hgz.bio1) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1PTR PRB 0.001073 0.47176 None
2 2OFE NAG 0.002977 0.44403 None
3 1UW1 ADP 0.002904 0.43827 None
4 2OFD NGA 0.003988 0.43824 None
5 2ALG HP6 0.0003173 0.42545 None
6 2ALG DAO 0.0003173 0.42545 None
7 1LNX URI 0.004348 0.42501 None
8 3SJ0 DXC 0.01634 0.41573 None
9 1T57 FMN 0.0002538 0.411 None
10 2O66 FLC 0.01428 0.40772 None
11 3IL6 B83 0.001847 0.40386 0.980392
12 1KYZ SAH 0.002748 0.40167 0.980392
13 2BII MTV 0.001011 0.40161 0.980392
14 1O68 KIV 0.001873 0.44061 1.09091
15 1XIU REA 0.0001594 0.44963 1.30435
16 1U5R ATP 0.002792 0.40928 1.30719
17 5D63 FUC GLA GLA 0.003411 0.44133 1.36519
18 1EB9 HBA 0.0004104 0.45034 1.52672
19 1XX4 BAM 0.002312 0.43961 1.53257
20 1VR0 3SL 0.0006892 0.45288 1.61943
21 2HFK E4H 0.00166 0.44284 1.63399
22 4DQ2 BTX 0.0001385 0.43176 1.63399
23 1H0C AOA 0.00792 0.43068 1.63399
24 2DVZ GLU 0.001848 0.42992 1.63399
25 3I8P 840 0.001255 0.42202 1.63399
26 3K3G MMU 0.008602 0.41487 1.63399
27 2QF7 COA 0.00288 0.41301 1.63399
28 2P41 G1G 0.002139 0.43259 1.63934
29 2P41 SAH 0.001927 0.40703 1.63934
30 1H9G COA MYR 0.0002329 0.42132 1.64609
31 3CEV ARG 0.009493 0.40583 1.67224
32 1AUA BOG 0.0005006 0.46501 1.68919
33 4ASJ N6A 0.0009908 0.40188 1.70648
34 1A8S PPI 0.006946 0.40471 1.8315
35 2YD6 FLC 0.002518 0.47752 1.88679
36 2ZWS PLM 0.006787 0.46591 1.96078
37 1UBY DMA 0.0003077 0.43944 1.96078
38 3TFC PEP 0.002942 0.43224 1.96078
39 1E2S CSN 0.001292 0.42615 1.96078
40 1ZFJ IMP 0.006084 0.42363 1.96078
41 1ML4 PAL 0.0005228 0.42033 1.96078
42 4KOA NDP 0.001329 0.41676 1.96078
43 1V6A TRE 0.009801 0.41496 1.96078
44 1UF5 CDT 0.0006015 0.44942 1.9802
45 4Q0A 4OA 0.001699 0.40893 1.98676
46 2Y7G AAE 0.0005853 0.43417 2.12766
47 3LTW HLZ 0.0007879 0.47035 2.14286
48 3UCJ AZM 0.001371 0.44056 2.20264
49 4WX0 HXD 0.0002728 0.44633 2.28137
50 2FGQ MLT 0.0009716 0.4662 2.28758
51 1KC7 PPR 0.001486 0.46506 2.28758
52 1ZGA HMK 0.0003458 0.45322 2.28758
53 4CIB 7UZ 0.001442 0.45166 2.28758
54 1ZGA SAH 0.001012 0.43015 2.28758
55 3NNF AKG 0.007884 0.42471 2.28758
56 2NVK NAP 0.00455 0.42417 2.28758
57 3NKS ACJ 0.001216 0.42253 2.28758
58 4J7H TLO 0.0005099 0.41866 2.28758
59 1TDF NAP 0.004583 0.41766 2.28758
60 3ULK NDP 0.0004451 0.41661 2.28758
61 2ZJF BSU 0.004597 0.41407 2.28758
62 1TDF FAD 0.002829 0.4096 2.28758
63 2QJN KDG 0.003815 0.40839 2.28758
64 1E7S NAP 0.001362 0.40477 2.28758
65 3O2K DST 0.01387 0.40348 2.28758
66 3O2K QRP 0.009325 0.40175 2.28758
67 3V1V GST 0.003579 0.4014 2.28758
68 4J7H TRH 0.002354 0.40029 2.28758
69 2VMD MBG 0.02662 0.41753 2.33463
70 3SHR CMP 0.002534 0.42443 2.34114
71 3P0F BAU 0.003862 0.4041 2.3569
72 3I7S PYR 0.009452 0.43353 2.39726
73 3PXP MYR 0.001742 0.41257 2.39726
74 1A27 EST 0.002879 0.40879 2.42215
75 1UAY ADN 0.002268 0.41692 2.47934
76 4JWX 1N4 0.001396 0.44604 2.5
77 1ZZ7 S0H 0.001692 0.44248 2.52525
78 3SCH TB6 0.01244 0.41564 2.52525
79 3A2Y TS5 0.0009649 0.42173 2.53807
80 2ZO9 MLI 0.005202 0.40967 2.55474
81 2Y6P CTP 0.001065 0.4395 2.5641
82 1JUV NDP 0.0002382 0.40831 2.59067
83 1F1V DHY 0.00006341 0.49561 2.61438
84 1R6W 164 0.00003956 0.47708 2.61438
85 1PEA ACM 0.002068 0.46599 2.61438
86 3PGU OLA 0.008566 0.45102 2.61438
87 2HGS GSH 0.0002851 0.4509 2.61438
88 4W6Z ETF 0.007706 0.44526 2.61438
89 4OB6 S2T 0.0002971 0.44497 2.61438
90 3FPZ AHZ 0.001751 0.43647 2.61438
91 1RZM E4P 0.007762 0.43109 2.61438
92 4OYA 1VE 0.004411 0.42983 2.61438
93 1PX8 XYP 0.005727 0.42527 2.61438
94 4AMV F6R 0.001473 0.41947 2.61438
95 1F3L SAH 0.0003931 0.41835 2.61438
96 2HGS ADP 0.0004172 0.41752 2.61438
97 2PUL ACP 0.001701 0.41718 2.61438
98 3SIX GDP 0.003428 0.41453 2.61438
99 1RZM PEP 0.008819 0.41189 2.61438
100 2PT9 S4M 0.0003253 0.40833 2.61438
101 4R33 SAH 0.001234 0.40747 2.61438
102 4R33 TRP 0.001234 0.40747 2.61438
103 3W54 RNB 0.005459 0.40251 2.61438
104 1VE3 SAM 0.0001203 0.444 2.64317
105 1OIK AKG 0.002229 0.44976 2.65781
106 2XI7 XI7 0.004418 0.47637 2.71739
107 2YBQ SAH 0.000433 0.42518 2.73973
108 3GF2 SAL 0.03428 0.4058 2.73973
109 1RYD GLC 0.01576 0.41094 2.84238
110 1U3I GSH 0.01104 0.41267 2.8436
111 3O7B SAH 0.002797 0.40141 2.86885
112 1QY1 PRZ 0.0001246 0.43884 2.87356
113 1NF8 BOG 0.0007003 0.48051 2.89855
114 1NF8 ISC 0.0009084 0.43694 2.89855
115 2WGC SIA GAL BGC 0.04595 0.41893 2.92398
116 1AX2 NDG GAL 0.0002906 0.47507 2.92887
117 3TKA CTN 0.002334 0.50114 2.94118
118 3JQ3 ADP 0.0001226 0.47705 2.94118
119 2XUM OGA 0.001412 0.4588 2.94118
120 3P3N AKG 0.001486 0.45779 2.94118
121 4B7E OGA 0.001107 0.45673 2.94118
122 1SQ5 PAU 0.001307 0.44726 2.94118
123 3NOJ PYR 0.002898 0.43537 2.94118
124 1FBL HTA 0.001498 0.43357 2.94118
125 1SQ5 ADP 0.001286 0.43107 2.94118
126 1PFK ADP 0.0007936 0.42932 2.94118
127 1GAD NAD 0.0001359 0.42857 2.94118
128 2Z9V PXM 0.003868 0.42718 2.94118
129 1A59 CIT 0.009559 0.4268 2.94118
130 2NCD ADP 0.006388 0.42317 2.94118
131 2JC9 ADN 0.009453 0.41061 2.94118
132 1WVG CXY 0.0007232 0.40984 2.94118
133 3TKA SAM 0.001279 0.40549 2.94118
134 1KBI FMN 0.0003211 0.40442 2.94118
135 1KBI PYR 0.0003211 0.40442 2.94118
136 1JQI CAA 0.0006787 0.4035 2.94118
137 2PP3 LGT 0.006245 0.4003 2.94118
138 3UDG TMP 0.008731 0.44247 2.99003
139 2CW6 3HG 0.001992 0.47536 3.02013
140 3RKR NAP 0.006145 0.40902 3.05344
141 2BZ1 TAU 0.003027 0.48558 3.06122
142 1XNK XS2 0.002008 0.41453 3.06122
143 2Q3M MLA 0.00009442 0.54306 3.06748
144 2JBH 5GP 0.000496 0.45877 3.11111
145 1MXI SAH 0.00002832 0.47069 3.125
146 2Q09 DI6 0.006532 0.41255 3.125
147 1T0I FMN 0.0007841 0.4206 3.14136
148 3RGG AIR 0.002765 0.42292 3.14465
149 3F8C HT1 0.0198 0.40143 3.1746
150 1FW1 GSH 0.001337 0.42558 3.24074
151 9LDT OXM 0.002995 0.47545 3.26797
152 9LDB OXM 0.003355 0.47282 3.26797
153 1GPJ CIT 0.000826 0.46941 3.26797
154 1I0Z OXM 0.003 0.46625 3.26797
155 3MD0 GDP 0.0007864 0.45052 3.26797
156 1H16 PYR 0.006813 0.44053 3.26797
157 3TXO 07U 0.0008445 0.43311 3.26797
158 4EPM AMP 0.0001954 0.424 3.26797
159 1V1A KDG 0.0004979 0.42104 3.26797
160 3Q9T FAY 0.0008325 0.4192 3.26797
161 1H16 DTL 0.03485 0.41145 3.26797
162 2EJU SAH 0.001642 0.40944 3.26797
163 2R42 FPS 0.001586 0.4061 3.26797
164 1QS8 IVA VAL VAL STA ALA STA 0.003066 0.40002 3.26797
165 2FOI JPA 0.002778 0.42284 3.34572
166 2HNK SAH 0.00153 0.40663 3.34728
167 4FFS BIG 0.001134 0.40004 3.34728
168 3H22 B53 0.001876 0.42966 3.367
169 3E5H GNP 0.0004606 0.40865 3.37079
170 2FR6 URI 0.0007856 0.42057 3.42466
171 2FR6 CTN 0.001359 0.4123 3.42466
172 3CBG FER 0.0008394 0.49455 3.44828
173 3CBG 4FE 0.003822 0.46979 3.44828
174 3RF4 FUN 0.001036 0.45156 3.44828
175 3CBG SAH 0.002951 0.40439 3.44828
176 1HFA PIO 0.02658 0.45361 3.46021
177 3KYF 5GP 5GP 0.0009745 0.44104 3.4632
178 4R3L COA 0.001357 0.41858 3.46821
179 1SJW NGV 0.004508 0.40163 3.47222
180 1G8S MET 0.001502 0.45758 3.47826
181 2BOI MFU 0.005871 0.41944 3.53982
182 1ZS6 ADP 0.004924 0.41763 3.5503
183 1MQ0 BRD 0.0005827 0.43919 3.57143
184 3L24 GOA 0.001171 0.48716 3.59477
185 1YBH P22 0.0001542 0.47307 3.59477
186 4M5P MLA 0.004621 0.46538 3.59477
187 1DXY COI 0.004277 0.45836 3.59477
188 4CCO OGA 0.001121 0.4501 3.59477
189 4M5P 23W 0.007288 0.43909 3.59477
190 4O8A 2OP 0.01292 0.43372 3.59477
191 3LST SAH 0.0009354 0.43144 3.59477
192 2F2U M77 0.002297 0.42614 3.59477
193 2R5T ANP 0.0003277 0.42499 3.59477
194 3CL5 SIO 0.01425 0.41857 3.59477
195 3MTW M3R 0.003072 0.40775 3.59477
196 1R37 NAD 0.001342 0.40758 3.59477
197 3BK2 U5P 0.007351 0.40164 3.59477
198 4GYW UDP 0.001839 0.4006 3.59477
199 1EYQ NAR 0.0003525 0.46489 3.6036
200 3SVL FMN 0.003482 0.40183 3.62694
201 3DCM SAM 0.001091 0.4116 3.64583
202 3WUC GLC GAL 0.01121 0.41772 3.64964
203 2AZ3 CDP 0.004295 0.42524 3.65854
204 3KJQ B94 0.001938 0.42416 3.65854
205 2B7N NTM 0.009939 0.41469 3.663
206 3ZS7 ATP 0.0006318 0.41172 3.66667
207 1Q6O LG6 0.0001413 0.4568 3.7037
208 3I51 45C 0.001516 0.4283 3.7037
209 1XHL NDP 0.001828 0.40069 3.7037
210 1I2L DCS 0.001264 0.40943 3.71747
211 2EB5 OXL 0.007791 0.42495 3.74532
212 3K56 IS3 0.0002367 0.45395 3.7594
213 1XVA SAM 0.001472 0.4072 3.76712
214 3O03 GCO 0.002533 0.47001 3.78007
215 2OHV NHL 0.004181 0.42056 3.78788
216 3F81 STT 0.001094 0.48866 3.82514
217 1P9B IMO 0.00002284 0.44857 3.84615
218 1P9B HDA 0.003546 0.43445 3.84615
219 1P9B GDP 0.001424 0.4157 3.84615
220 3PMA SCR 0.006105 0.41872 3.861
221 2C2A ADP 0.0002643 0.4418 3.87597
222 3IPQ 965 0.0001746 0.40065 3.88693
223 1YFZ IMP 0.005568 0.42581 3.90244
224 1QD0 RR6 0.002064 0.42309 3.90625
225 1Z42 HBA 0.000109 0.57862 3.92157
226 3U1T MLI 0.0003024 0.49774 3.92157
227 2XDQ MGX 0.001543 0.48103 3.92157
228 2W8Q SIN 0.001134 0.47061 3.92157
229 4WBD ADP 0.001398 0.46632 3.92157
230 4WBD CIT 0.003431 0.45519 3.92157
231 1KTC NGA 0.001389 0.44614 3.92157
232 2HEK GDP 0.0008574 0.44327 3.92157
233 1Z42 FMN 0.0009185 0.43675 3.92157
234 4C6F DOR 0.001332 0.43561 3.92157
235 4C6F NCD 0.001332 0.43561 3.92157
236 1Z44 NPO 0.0264 0.43264 3.92157
237 1MOQ GLP 0.0005795 0.42516 3.92157
238 1Q3Q ANP 0.001715 0.42464 3.92157
239 2I4O ATP 0.003006 0.42146 3.92157
240 1EYE PMM 0.002634 0.41898 3.92157
241 3K5X P8D 0.004123 0.41597 3.92157
242 1Z41 FMN 0.002506 0.411 3.92157
243 1Z48 FMN 0.002526 0.41087 3.92157
244 1Z44 FMN 0.003374 0.41041 3.92157
245 1GSA ADP 0.0007932 0.40855 3.92157
246 1NHZ 486 0.0006781 0.41074 3.92857
247 4AIG FLX 0.0001643 0.47196 3.9801
248 1ZUW DGL 0.003976 0.42147 4.04412
249 1B5E DCM 0.001713 0.43657 4.06504
250 4KGM ATP 0.007456 0.4014 4.08163
251 2PYU IMP 0.0003495 0.47876 4.10959
252 2GDZ NAD 0.0002828 0.4236 4.11985
253 1R5A GTS 0.009175 0.40644 4.12844
254 3QP6 HL6 0.0004296 0.44419 4.15094
255 4JCA CIT 0.004635 0.46531 4.19162
256 3RK0 AMP 0.003357 0.41488 4.21941
257 4RJK PYR 0.0005688 0.49353 4.24837
258 3IHB TRS 0.0008599 0.48458 4.24837
259 1O9U ADZ 0.002491 0.47039 4.24837
260 3IHB GLU 0.001855 0.46052 4.24837
261 3T1A 5MA 0.000111 0.45008 4.24837
262 2WQP WQP 0.0000484 0.44248 4.24837
263 3ZGE ASP 0.006657 0.44103 4.24837
264 3ZUY TCH 0.001104 0.43888 4.24837
265 3QV9 QV7 0.004301 0.43075 4.24837
266 2O2C G6Q 0.001959 0.41492 4.24837
267 3LIH RAF 0.001929 0.40701 4.24837
268 2YPO PHE 0.0001049 0.4056 4.24837
269 3QO8 SSA 0.003568 0.40537 4.24837
270 1FP2 SAH 0.005262 0.40312 4.24837
271 3H9E NAD 0.0003938 0.40143 4.24837
272 1MZV AMP 0.004279 0.41532 4.25532
273 2WK1 SAH 0.001307 0.40517 4.25532
274 3ZF8 GDP 0.006713 0.40748 4.2623
275 4IXW IXW 0.006417 0.41287 4.33071
276 1YGC 905 0.002053 0.40231 4.33071
277 5RHN 8BR 0.001176 0.42306 4.34783
278 4U9W SER GLY ARG GLY LYS NH2 0.01091 0.41553 4.34783
279 4U9W COA 0.002012 0.41034 4.34783
280 2ZE3 AKG 0.00101 0.45847 4.36364
281 3R51 MMA 0.01236 0.43472 4.375
282 3QP4 HL0 0.000486 0.43713 4.3956
283 1UJ5 5RP 0.007774 0.40069 4.40529
284 2Q37 3AL 0.003445 0.435 4.41989
285 3HY3 10F 0.0008881 0.40337 4.4335
286 4OJ8 2TQ 0.0003376 0.42047 4.43686
287 4OJ8 AKG 0.001602 0.40596 4.43686
288 2VQ5 LDP 0.00425 0.4585 4.47761
289 2VQ5 HBA 0.002522 0.45421 4.47761
290 2Y0I AKG 0.0006512 0.46686 4.57516
291 2X2T GAL NGA 0.004986 0.45495 4.57516
292 2R00 OEG 0.003576 0.44704 4.57516
293 3A1I UNU 0.0008191 0.44406 4.57516
294 4USS GSH 0.00162 0.44329 4.57516
295 1TFZ 869 0.0001387 0.44191 4.57516
296 1YOE RIB 0.00144 0.43968 4.57516
297 3W2W ATP 0.001758 0.4258 4.57516
298 1AUX AGS 0.0007759 0.42511 4.57516
299 1K6M AGS 0.0005871 0.41275 4.57516
300 1CBF SAH 0.002526 0.41087 4.57516
301 1R27 MGD 0.001534 0.40815 4.57516
302 2IXB NAD 0.0001063 0.40198 4.57516
303 1H8P PC 0.006227 0.45 4.58716
304 1V2X SAM 0.0004523 0.42454 4.63918
305 1VQ2 DDN 0.003193 0.40318 4.66321
306 1HQL GLA MBG 0.002172 0.45728 4.66926
307 3P7I P7I 0.0001604 0.48605 4.6729
308 4PO2 ASN ARG LEU LEU LEU THR GLY 0.0003049 0.40724 4.68085
309 1Y9Q MED 0.002938 0.44429 4.6875
310 4LXH C1E 0.001291 0.41721 4.69314
311 4TMK T5A 0.0307 0.40127 4.69484
312 2DWU DGL 0.0006233 0.45468 4.71014
313 2YLD CMO 0.00009464 0.51228 4.72441
314 4K7O EKZ 0.00534 0.43879 4.7619
315 1ZJ6 G3D 0.0002618 0.45791 4.81283
316 2QGI UDP 0.01777 0.40351 4.83871
317 1Y7I SAL 0.004137 0.42593 4.85075
318 3UST FAD 0.001565 0.4185 4.86891
319 1F5F DHT 0.0006498 0.42786 4.87805
320 4LHM AZZ 0.000188 0.49061 4.90196
321 2YIV NBN 0.0004395 0.49007 4.90196
322 2YIV YIV 0.001621 0.47119 4.90196
323 4C2G ALA ALA ALA ALA 0.0004541 0.46035 4.90196
324 3GTD MLI 0.001861 0.44678 4.90196
325 3GJB AKG 0.001109 0.44436 4.90196
326 1CKN GTP 0.00165 0.43724 4.90196
327 4KCF FMN 0.0009702 0.43583 4.90196
328 2RCN GDP 0.002711 0.42326 4.90196
329 2VHJ ADP 0.0005459 0.42178 4.90196
330 1CKM GTP 0.004348 0.41986 4.90196
331 2CE7 ADP 0.001957 0.41934 4.90196
332 3RHZ UDP 0.0008562 0.41927 4.90196
333 4UAL 3FV 0.00181 0.41198 4.90196
334 4BG1 IVL 0.0008443 0.41144 4.90196
335 4BG1 OGA 0.0008443 0.41144 4.90196
336 4KCF AKM 0.000765 0.40541 4.90196
337 1PR9 NAP 0.0003015 0.42715 4.91803
338 4JEJ 1GP 0.001681 0.42656 4.91803
339 2HW1 ANP 0.0001812 0.43348 5.03356
340 2HW1 FRU 0.004451 0.4301 5.03356
341 4F2Q QUS 0.004417 0.40599 5.03876
342 3FKQ ATP 0.001223 0.41805 5.09383
343 3N5O GSH 0.001107 0.4154 5.10638
344 3WUD GLC GAL 0.01385 0.42534 5.14706
345 1TRD PGH 0.001514 0.42832 5.2
346 4JLV ADP 0.02766 0.42743 5.20446
347 3K3K A8S 0.0006454 0.41932 5.21327
348 2P69 PLP 0.0003308 0.47981 5.22876
349 4ME6 ADP 0.0006585 0.46665 5.22876
350 1YHM AHD 0.001885 0.44654 5.22876
351 2VAR AMP 0.0007445 0.44572 5.22876
352 3NFZ 3NF 0.00103 0.43482 5.22876
353 2VAR ANP 0.0001898 0.43281 5.22876
354 4NAO AKG 0.00807 0.43029 5.22876
355 3CQ5 PMP 0.002445 0.43019 5.22876
356 4AQL TXC 0.000649 0.42788 5.22876
357 2VAR KDG 0.001898 0.42451 5.22876
358 3L6R MLI 0.01203 0.42206 5.22876
359 2VAR KDF 0.003468 0.41433 5.22876
360 3AYS CT3 0.004854 0.41312 5.22876
361 1T10 F6P 0.01138 0.41209 5.22876
362 3B9Z CO2 0.0162 0.41039 5.22876
363 1C7S CBS 0.004659 0.40935 5.22876
364 2C31 TZD 0.008329 0.40884 5.22876
365 1LYX PGA 0.0006257 0.43803 5.24194
366 1TUV VK3 0.00113 0.48795 5.26316
367 2OYS FMN 0.001321 0.40503 5.3719
368 2OI2 DP6 0.0003593 0.45258 5.47945
369 1ECM TSA 0.0008285 0.44958 5.50459
370 1Q3P GLU ALA GLN THR ARG LEU 0.001419 0.43994 5.50459
371 1DL7 NCH 0.04005 0.42234 5.50459
372 1NNS ASP 0.001837 0.43002 5.52147
373 1SOW OXL 0.001619 0.47996 5.55556
374 2QLX RM4 0.0008635 0.47621 5.55556
375 3BRE C2E 0.001331 0.45998 5.55556
376 3I6B KDO 0.0007508 0.45751 5.55556
377 4G1V FAD 0.01504 0.40834 5.55556
378 3DER ALA LYS 0.001294 0.40171 5.55556
379 2QDT I38 0.004541 0.40152 5.57621
380 4K30 NLG 0.001756 0.4418 5.625
381 2IYG FMN 0.0001969 0.46272 5.64516
382 1KDK DHT 0.0006593 0.41113 5.64972
383 2QCX PF1 0.0006501 0.4669 5.70342
384 2WCV FUC 0.004672 0.41379 5.71429
385 3JQM GTP 0.0001472 0.48052 5.73248
386 1FMB HYB 0.0007256 0.44073 5.76923
387 3BHO B4P 0.0223 0.42867 5.76923
388 4AF5 CIT 0.000462 0.48091 5.78947
389 1JH7 UVC 0.01811 0.40315 5.82011
390 2JFV FLC 0.003144 0.44294 5.84192
391 2IZ1 ATR 0.0001814 0.4994 5.88235
392 1WDA BAG 0.001284 0.44172 5.88235
393 1GJW GLC 0.005964 0.43652 5.88235
394 2Q28 ADP 0.0003098 0.4301 5.88235
395 1B8U NAD 0.0003258 0.42508 5.88235
396 1GJW MAL 0.005229 0.41183 5.88235
397 1NML CIT 0.01388 0.40346 5.88235
398 5EQU AKG 0.0008781 0.48427 5.90164
399 3FXU TSU 0.00001133 0.45788 5.90164
400 3WCS MAN NAG 0.001021 0.45182 5.90551
401 3WCS MAN NAG GAL 0.0006616 0.44777 5.90551
402 3S9K CIT 0.004207 0.49826 5.9322
403 1JHG TRP 0.01691 0.40447 5.94059
404 3DX5 DHB 0.00346 0.41902 5.94406
405 3IBH GSH 0.0006773 0.41861 6.00858
406 1Y1A GSH 0.00652 0.46795 6.01093
407 1JAC AMG 0.003384 0.47262 6.01504
408 3KMZ EQO 0.0005153 0.40228 6.01504
409 1QH9 LAC 0.0000938 0.51245 6.03448
410 4B4D FAD 0.0009997 0.40902 6.10687
411 3D2Y AH0 ALA FGA LYS 0.0005265 0.42661 6.13027
412 2DTJ THR 0.002086 0.42781 6.17978
413 2ZJ5 ADP 0.00008464 0.50586 6.20915
414 3ZPG 5GP 0.000628 0.50099 6.20915
415 3SQG COM 0.02037 0.43079 6.20915
416 4LKK SIA GAL 0.0005672 0.42549 6.20915
417 3IB8 AMP 0.003001 0.41233 6.20915
418 1V5F TPP 0.03159 0.40896 6.20915
419 1V5F FAD 0.03159 0.40896 6.20915
420 3SQG TP7 0.0048 0.40063 6.20915
421 2P1M IHP 0.0005278 0.4086 6.25
422 3LM9 ADP 0.006522 0.40366 6.29139
423 4LO6 SIA GAL 0.002056 0.46217 6.31579
424 1QB7 ADE 0.005485 0.411 6.35593
425 1L2T ATP 0.000529 0.41043 6.38298
426 4DN8 BMA 0.02144 0.40479 6.41026
427 2Y7P SAL 0.005044 0.42226 6.42202
428 1Z45 GAL 0.001248 0.44812 6.53595
429 3UER TUR 0.0009179 0.43676 6.53595
430 3UER BTU 0.0009179 0.43676 6.53595
431 4EPL JAI 0.0006552 0.43237 6.53595
432 1HDG NAD 0.0002705 0.41094 6.53595
433 2PFC PLM 0.001128 0.43329 6.55738
434 1C1L GAL BGC 0.00172 0.46207 6.56934
435 1BTN I3P 0.0003164 0.54874 6.60377
436 1YRX FMN 0.0008419 0.43316 6.61157
437 2GJ3 FAD 0.0002559 0.43291 6.66667
438 4A6F SEP 0.03637 0.41716 6.66667
439 1Y75 NAG 0.0007631 0.45105 6.77966
440 1Z6K OAA 0.009009 0.40024 6.82594
441 4Q3F TLA 0.01979 0.40639 6.83761
442 1QZZ SAM 0.002989 0.4124 6.86275
443 3UBW 6SP 0.0001894 0.5756 6.89655
444 4WVW SLT 0.01872 0.44206 6.94444
445 1IM8 SAI 0.0008173 0.4119 6.96721
446 2XRH NIO 0.001214 0.46921 7
447 1Y13 BIO 0.006343 0.40847 7.18232
448 2C5S AMP 0.0006302 0.45448 7.18954
449 3HZL 6PC 0.006466 0.44916 7.18954
450 3PMD 11A 0.0009641 0.44123 7.18954
451 4HA6 PXM 0.01547 0.40619 7.18954
452 1VJO PLP 0.004251 0.40257 7.18954
453 1I36 NAP 0.0004151 0.41373 7.19697
454 3W8S GSH 0.002949 0.43798 7.28155
455 1EJE FMN 0.001247 0.4136 7.29167
456 1XE7 GUN 0.003228 0.46462 7.38916
457 1POC GEL 0.001899 0.41124 7.46269
458 3L0E G58 0.0002695 0.40596 7.50988
459 3MAG 3MA 0.01335 0.44067 7.51634
460 2D0V PQQ 0.0004249 0.42546 7.51634
461 1W7J ADP BEF 0.0009353 0.42221 7.51634
462 3CF6 SP1 0.001557 0.41859 7.51634
463 4IHQ ADP 0.005873 0.41446 7.51634
464 1P1M MET 0.0008657 0.40732 7.51634
465 3S2Y FMN 0.001353 0.41237 7.53769
466 3KMT SAH 0.001541 0.42326 7.56302
467 1T3D CYS 0.00012 0.51671 7.61246
468 1Y7P RIP 0.03133 0.40775 7.62332
469 2VDJ HSE 0.001248 0.47677 7.6412
470 4COQ SAN 0.0001665 0.5011 7.69231
471 1H2M OGA 0.00158 0.45657 7.69231
472 2VPR TDC 0.004074 0.40325 7.72947
473 3MCT 3MC 0.009727 0.41007 7.74411
474 3BY8 MLT 0.0003048 0.49758 7.74648
475 2RHQ GAX 0.0006725 0.41085 7.82313
476 1VBH PEP 0.0002724 0.48352 7.84314
477 1WHT BZS 0.0006351 0.47461 7.84314
478 4HZO COA 0.001126 0.45001 7.84314
479 1M7Y PPG 0.00005454 0.41098 7.84314
480 6FIV 3TL 0.005052 0.40378 7.9646
481 4B9E FAH 0.00002922 0.54568 7.97342
482 1GVF PGH 0.002999 0.43189 8.04196
483 4NPT 017 0.0007014 0.44676 8.08081
484 1RYI GOA 0.01122 0.45614 8.16993
485 1ZED PNP 0.002721 0.45265 8.16993
486 3DG6 MUC 0.0005926 0.43892 8.16993
487 3JDW ORN 0.0006183 0.4333 8.16993
488 4EXO PYR 0.003552 0.45445 8.21918
489 1A5V Y3 0.0007896 0.46318 8.22785
490 1N9L FMN 0.0007553 0.42116 8.25688
491 4F8L GAL 0.0084 0.4607 8.27586
492 3NCQ ATP 0.0003358 0.42464 8.40336
493 1H8G CHT 0.01248 0.45104 8.42105
494 1V2G OCA 0.001148 0.43299 8.42105
495 1Y2W NAG 0.002329 0.44889 8.4507
496 4FGC PQ0 0.004581 0.42954 8.48485
497 2Q8H TF4 0.0002455 0.52185 8.49673
498 1I1Q TRP 0.0005494 0.45694 8.49673
499 4KCT PYR 0.0005676 0.45636 8.49673
500 4L7I SAM 0.0007287 0.42608 8.49673
501 4KCT FDP 0.005324 0.40709 8.49673
502 3E81 SLB 0.00009268 0.50413 8.53659
503 4NES UDP 0.0001492 0.40182 8.55615
504 1C3V PDC 0.001539 0.45042 8.57143
505 1M1B SPV 0.003002 0.43764 8.81356
506 2OWZ CIT 0.001166 0.46259 8.82353
507 2Q8M AMP 0.001356 0.43018 8.82353
508 4TSK NDP 0.005399 0.40717 8.82353
509 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 0.00008114 0.53504 8.84354
510 4IMG NGF 0.000969 0.41335 8.87372
511 2D5X L35 0.01451 0.40742 8.90411
512 2W3L DRO 0.0005451 0.50414 9.02778
513 3B96 MYA 0.001999 0.4027 9.02896
514 2J5S KTA 0.0007014 0.42228 9.12547
515 2BO4 FLC 0.0004436 0.48988 9.15033
516 1WRA PC 0.003114 0.44988 9.15033
517 1E4E PHY 0.0004777 0.43741 9.15033
518 2GWD GLU 0.002459 0.43008 9.15033
519 1E4E ADP 0.0009433 0.41781 9.15033
520 2YVF NAD 0.007133 0.40569 9.15033
521 2YVF FAD 0.009414 0.40074 9.15033
522 3V1U HXC 0.0103 0.40002 9.15033
523 2YFT DQR 0.003599 0.40523 9.47712
524 1Y8O ADP 0.008146 0.40411 9.47712
525 3UIE ANP 0.0009583 0.44133 9.5
526 3UIE ADX 0.002964 0.41254 9.5
527 5FIT AP2 0.00163 0.42708 9.52381
528 1OGZ EQU 0.001825 0.42517 9.6
529 4BI7 PGA 0.000792 0.45039 9.72763
530 1H2K OGA 0.001302 0.46041 9.7561
531 1WTC ACP 0.01676 0.41521 9.80392
532 2JAR UMP 0.001942 0.40691 10
533 1T0S BML 0.0004121 0.50039 10.1307
534 2R40 20E 0.0001141 0.42719 10.1504
535 1NU4 MLA 0.01547 0.44577 10.3093
536 3VPD ANP 0.0001808 0.41195 10.3203
537 1UOU CMU 0.0002243 0.45483 10.3376
538 1NP0 NGT 0.001483 0.45783 10.3448
539 4WVH ASP HIS ASP ALA HIS ALA 0.0006346 0.45436 10.4575
540 4JP3 CIT 0.002012 0.42352 10.4603
541 1QO0 BMD 0.003324 0.44184 10.7143
542 4G28 0W8 0.0005329 0.45749 10.7843
543 4BT5 23B 0.001563 0.4382 10.8949
544 2Q1A 2KT 0.001569 0.45672 10.9215
545 4LFL TG6 0.004664 0.41382 11.1111
546 1QDS PGA 0.0007458 0.44569 11.1554
547 3QDW NDG 0.000477 0.48839 11.1888
548 3QDT A2G GAL 0.001316 0.47564 11.1888
549 3QDW A2G 0.002001 0.47526 11.1888
550 3QDY A2G GAL 0.001407 0.47421 11.1888
551 3QDV A2G 0.008466 0.44316 11.1888
552 3QDV NDG 0.006918 0.43346 11.1888
553 3QDY CBS 0.00792 0.43068 11.1888
554 3GM5 CIT 0.0002648 0.49192 11.3208
555 3PC3 P1T 0.00008349 0.44457 11.4379
556 4M51 BEZ 0.0112 0.4299 11.4379
557 3I0O ADP 0.002347 0.42577 11.4379
558 1R89 CTP 0.001861 0.41574 11.4379
559 3I0O SMI 0.00994 0.41469 11.4379
560 3CH5 GDP 0.00552 0.40648 11.5385
561 1SS4 GSH 0.00001884 0.61528 11.7647
562 1SS4 CIT 0.04417 0.44758 11.7647
563 2V5E SCR 0.0007497 0.5076 11.8812
564 1ULE GLA GAL NAG 0.02153 0.41586 12
565 1B74 DGN 0.02045 0.41696 12.2047
566 1P72 THM 0.001199 0.44886 12.4183
567 3DGB MUC 0.002275 0.42146 12.4183
568 1SC3 MLI 0.01181 0.42876 12.5
569 1EP2 ORO 0.0000151 0.41624 12.6437
570 1EP2 FMN 0.0001405 0.41207 12.6437
571 1JGS SAL 0.002358 0.49167 13.0435
572 4F4S EFO 0.0003216 0.4732 13.1579
573 4M2K PLP 0.001518 0.43873 13.3987
574 4G4S LDZ 0.0004864 0.43235 13.617
575 3PLN U5P 0.001631 0.44316 13.7255
576 3EJ0 11X 0.01452 0.40496 13.7755
577 1YOA FMN 0.0218 0.43736 13.8365
578 2BLE 5GP 0.004645 0.41091 14.0523
579 1NME 159 0.002563 0.46975 14.1304
580 4GO7 THR 0.0003965 0.45667 14.5
581 1OGD RIP 0.006081 0.41879 14.5038
582 2E1A MSE 0.0002114 0.47405 14.6667
583 4DYO SD4 0.006472 0.41272 14.7059
584 3A2Q ACA ACA 0.0001828 0.44751 15.3595
585 1T8U A3P 0.0006761 0.41863 15.8088
586 4N7C AEF 0.0008748 0.47595 15.9091
587 2PR5 FMN 0.0006779 0.42279 16.6667
588 4CCN OGA 0.003468 0.441 17.1429
589 3T2W BTN 0.0008653 0.44311 17.2131
590 1KYV RBF 0.003288 0.40272 18.239
591 1EZV SMA 0.0004026 0.40043 24.3243
592 1UO4 PIH 0.000833 0.50515 26.4706
593 1UO5 PIH 0.002772 0.48773 26.4706
594 2ZSC BTN 0.001706 0.42159 31.2057
595 2FYU FDN 0.001677 0.40913 32.0988
596 2G36 TRP 0.000000003515 0.46727 32.3529
597 3PNA CMP 0.00324 0.42514 32.4675
598 3KPE TM3 0.005147 0.43317 33.3333
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