Receptor
PDB id Resolution Class Description Source Keywords
1x7w 1.73 Å EC: 1.2.4.4 CRYSTAL STRUCTURE OF THE HUMAN MITOCHONDRIAL BRANCHED-CHAIN KETOACID DEHYDROGENASE HOMO SAPIENS OXIDOREDUCTASEKETOACID DEHYDROGENASE BRANCHED-CHAIN MULTICOMPLEX ACYLATION OXIDATIVE DECARBOXYLATION MAPLE SYRUP UDISEASE THIAMIN DIPHOSPHATE PHOSPHORYLATION FLAVOPROTEINOXIDOREDUCTASE
Ref.: MOLECULAR MECHANISM FOR REGULATION OF THE HUMAN MITOCHONDRIAL BRANCHED-CHAIN ALPHA-KETOACID DEHYDRO COMPLEX BY PHOSPHORYLATION STRUCTURE V. 12 2185 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:704;
Invalid;
none;
submit data
35.453 Cl [Cl-]
GOL B:901;
Invalid;
none;
submit data
92.094 C3 H8 O3 C(C(C...
K A:701;
B:702;
Part of Protein;
Part of Protein;
none;
none;
submit data
39.098 K [K+]
MN A:703;
Part of Protein;
none;
submit data
54.938 Mn [Mn+2...
TDP A:801;
Valid;
none;
Kd = 60.9 uM
424.306 C12 H18 N4 O7 P2 S Cc1c(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1OLS 1.85 Å EC: 1.2.4.4 ROLES OF HIS291-ALPHA AND HIS146-BETA' IN THE REDUCTIVE ACYLATION REACTION CATALYZED BY HUMAN BRANCHED-CHAIN A LPHA-KETOACID DEHYDROGENASE HOMO SAPIENS OXIDOREDUCTASE KETOACID DEHYDROGENASE BRANCHED-CHAIN MULTI-ENZYME COMPLEX ACYLATION OXIDATIVE DECARBOXYLATION MAPLE SYRUP URINE DISEASE THIAMINE PHOSPHATE
Ref.: ROLES OF HIS291-ALPHA AND HIS146-BETA' IN THE REDUCTIVE ACYLATION REACTION CATALYZED BY HUMAN BRANCHED-CHAIN ALPHA-KETOACID DEHYDROGENASE: REFINED PHOSPHORYLATION LOOP STRUCTURE IN THE ACTIVE SITE. J.BIOL.CHEM. V. 278 43402 2003
Members (22)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1X7Z Kd = 40.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
2 1OLX Kd = 47.1 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
3 1V11 Kd = 104.8 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
4 1V16 Kd = 134.8 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
5 2BFC - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
6 2BFD - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
7 2J9F - THV C16 H26 N4 O8 P2 S Cc1c(sc([n....
8 1X7W Kd = 60.9 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
9 2BFE - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
10 1X80 Kd = 89.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
11 2BEV - THY C17 H28 N4 O8 P2 S CC[C@H](C)....
12 1OLS Kd = 1.52 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
13 1X7Y Kd = 54.4 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
14 2BFF - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
15 2BEW - THW C19 H24 N4 O8 P2 S Cc1c(sc([n....
16 1OLU Kd = 39.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
17 2BEU - THV C16 H26 N4 O8 P2 S Cc1c(sc([n....
18 2BFB - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
19 1X7X Kd = 52.6 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
20 1WCI - WWF C17 H29 N4 O8 P2 S Cc1c(sc([n....
21 1V1M Kd = 115 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
22 1U5B Kd = 1.6 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
70% Homology Family (22)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1X7Z Kd = 40.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
2 1OLX Kd = 47.1 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
3 1V11 Kd = 104.8 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
4 1V16 Kd = 134.8 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
5 2BFC - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
6 2BFD - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
7 2J9F - THV C16 H26 N4 O8 P2 S Cc1c(sc([n....
8 1X7W Kd = 60.9 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
9 2BFE - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
10 1X80 Kd = 89.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
11 2BEV - THY C17 H28 N4 O8 P2 S CC[C@H](C)....
12 1OLS Kd = 1.52 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
13 1X7Y Kd = 54.4 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
14 2BFF - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
15 2BEW - THW C19 H24 N4 O8 P2 S Cc1c(sc([n....
16 1OLU Kd = 39.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
17 2BEU - THV C16 H26 N4 O8 P2 S Cc1c(sc([n....
18 2BFB - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
19 1X7X Kd = 52.6 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
20 1WCI - WWF C17 H29 N4 O8 P2 S Cc1c(sc([n....
21 1V1M Kd = 115 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
22 1U5B Kd = 1.6 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
50% Homology Family (22)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1X7Z Kd = 40.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
2 1OLX Kd = 47.1 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
3 1V11 Kd = 104.8 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
4 1V16 Kd = 134.8 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
5 2BFC - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
6 2BFD - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
7 2J9F - THV C16 H26 N4 O8 P2 S Cc1c(sc([n....
8 1X7W Kd = 60.9 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
9 2BFE - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
10 1X80 Kd = 89.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
11 2BEV - THY C17 H28 N4 O8 P2 S CC[C@H](C)....
12 1OLS Kd = 1.52 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
13 1X7Y Kd = 54.4 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
14 2BFF - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
15 2BEW - THW C19 H24 N4 O8 P2 S Cc1c(sc([n....
16 1OLU Kd = 39.3 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
17 2BEU - THV C16 H26 N4 O8 P2 S Cc1c(sc([n....
18 2BFB - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
19 1X7X Kd = 52.6 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
20 1WCI - WWF C17 H29 N4 O8 P2 S Cc1c(sc([n....
21 1V1M Kd = 115 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
22 1U5B Kd = 1.6 uM TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: TDP; Similar ligands found: 32
No: Ligand ECFP6 Tc MDL keys Tc
1 TDP 1 1
2 TPP 0.84 0.985714
3 V4E 0.797468 0.985714
4 TPS 0.77027 0.942857
5 TMV 0.75 0.944444
6 VNP 0.703704 0.945205
7 N1T 0.674699 1
8 2TP 0.609195 0.918919
9 VIB 0.605263 0.760563
10 5SR 0.582418 0.958333
11 FTP 0.574713 0.847222
12 O2T 0.546392 0.896104
13 PYI 0.483871 0.873239
14 TDW 0.474227 0.958333
15 HTL 0.474227 0.945205
16 THV 0.46 0.945205
17 TD6 0.457143 0.907895
18 WWF 0.455446 0.92
19 TOG 0.451923 0.907895
20 TPW 0.451613 0.885714
21 THY 0.45098 0.932432
22 TD9 0.448598 0.907895
23 TD8 0.448598 0.907895
24 THW 0.447619 0.945205
25 TDL 0.446602 0.884615
26 TDK 0.442308 0.907895
27 D7K 0.415929 0.896104
28 TPU 0.410526 0.828947
29 R1T 0.405941 0.873239
30 S1T 0.405941 0.873239
31 T6F 0.403509 0.884615
32 T5X 0.403509 0.884615
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1OLS; Ligand: TDP; Similar sites found: 352
This union binding pocket(no: 1) in the query (biounit: 1ols.bio1) has 72 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1Y9Q MED 0.03858 0.41262 1.5625
2 2Z1U ATP 0.007663 0.41503 1.75439
3 2HEK GDP 0.001697 0.45535 1.88679
4 2P41 G1G 0.01544 0.41798 1.96721
5 4M5P MLA 0.002002 0.50851 2
6 4M5P FMN 0.0001386 0.46469 2
7 4M5P 23W 0.04095 0.42148 2
8 3DG6 MUC 0.002259 0.44054 2.04678
9 2NCD ADP 0.01916 0.42266 2.04678
10 1T10 F6P 0.04527 0.40478 2.04678
11 1JN2 SFP 0.001709 0.55921 2.1097
12 3L24 GOA 0.004989 0.4774 2.25
13 3FSJ D7K 0.002094 0.41903 2.25
14 3B9Z CO2 0.03031 0.41782 2.31959
15 2Q09 DI6 0.002114 0.45644 2.33918
16 1Y42 TYR 0.006636 0.43924 2.33918
17 2RCN GDP 0.01334 0.4166 2.33918
18 1X8X TYR 0.01864 0.41028 2.48447
19 4LHM AZZ 0.01604 0.42633 2.5
20 3P3N AKG 0.02004 0.42668 2.5788
21 4B7E OGA 0.02135 0.42042 2.5788
22 1E4E PHY 0.001245 0.44652 2.62391
23 4KCT PYR 0.01656 0.41661 2.63158
24 1UOU CMU 0.008718 0.41651 2.63158
25 1AUA BOG 0.01632 0.42128 2.7027
26 1YBH P22 0.002177 0.47663 2.75
27 3PLN U5P 0.005349 0.44354 2.75
28 4HA6 PXM 0.03997 0.41739 2.75591
29 3TKA CTN 0.03942 0.41649 2.88184
30 1QRD DQN 0.02483 0.43302 2.9304
31 1LL2 UPG 0.006265 0.40485 3.003
32 2OHV NHL 0.005459 0.43811 3.0303
33 2R42 FPS 0.007383 0.40539 3.03797
34 1NML CIT 0.0094 0.4323 3.06748
35 1QR0 COA 0.01975 0.40918 3.07018
36 3BRE C2E 0.02757 0.41985 3.07263
37 4USS GSH 0.007714 0.43624 3.07692
38 3DX5 DHB 0.01189 0.41878 3.14685
39 4W6Z ETF 0.01903 0.43913 3.17003
40 2VAR AMP 0.001417 0.45873 3.19489
41 2VAR KDG 0.001666 0.45067 3.19489
42 2VAR ANP 0.005416 0.40714 3.19489
43 4O8A 2OP 0.01065 0.45946 3.21637
44 2CFU 1DB 0.003458 0.4142 3.21637
45 1FW1 GSH 0.01756 0.404 3.24074
46 2F2U M77 0.001802 0.45422 3.25
47 3O2K QRP 0.0131 0.41694 3.25
48 1Z44 NPO 0.004271 0.49987 3.25444
49 1Z42 HBA 0.01563 0.47415 3.25444
50 1RZM E4P 0.01449 0.43921 3.25444
51 1Z44 FMN 0.005284 0.42543 3.25444
52 1RZM PEP 0.01394 0.42442 3.25444
53 1Z41 FMN 0.01249 0.40654 3.25444
54 1Z42 FMN 0.02582 0.40049 3.25444
55 1O68 KIV 0.002561 0.45819 3.27273
56 1NXJ TLA 0.004289 0.42315 3.27869
57 1NXJ GLV 0.03854 0.40011 3.27869
58 2B7N NTM 0.02541 0.41681 3.2967
59 4DYO SD4 0.03185 0.40385 3.29897
60 3RK0 AMP 0.02594 0.40041 3.37553
61 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 0.02978 0.42884 3.40136
62 4Q3F TLA 0.04631 0.40867 3.4188
63 3V91 UPG 0.005723 0.4032 3.43643
64 4QVH FLC 0.02662 0.45422 3.5
65 4LIT AKG 0.0109 0.43431 3.5
66 3M6W SAM 0.003721 0.42756 3.5
67 3QO8 SSA 0.007135 0.41627 3.5
68 1PEA ACM 0.0127 0.44837 3.50877
69 1Z45 GAL 0.02365 0.41384 3.50877
70 3I0O ADP 0.008963 0.42409 3.53982
71 5EQU AKG 0.02468 0.43316 3.60656
72 4COQ SAN 0.03826 0.4128 3.64372
73 1Q6O LG6 0.0006529 0.45768 3.7037
74 3GX0 GDS 0.008321 0.40346 3.72093
75 2NVK NAP 0.04524 0.40073 3.75
76 2R5T ANP 0.001635 0.42243 3.75335
77 3GJB AKG 0.0002808 0.49537 3.76176
78 3K3K A8S 0.002998 0.4199 3.79147
79 1XX4 BAM 0.0484 0.40133 3.83142
80 1NF8 ISC 0.004905 0.43096 3.86473
81 4U9W SER GLY ARG GLY LYS NH2 0.02919 0.41623 3.86473
82 1CKM GTP 0.0008038 0.47509 3.93939
83 1S8F GDP 0.01613 0.40552 3.9548
84 2VDJ HSE 0.03773 0.42338 3.98671
85 3TFC PEP 0.003838 0.45014 4
86 3E9K 3XH 0.01557 0.41781 4
87 4IHQ ADP 0.02765 0.40661 4
88 4B16 NAG 0.004048 0.4912 4.13534
89 1H2B OCA 0.01965 0.42215 4.17827
90 1S2D ADE 0.01232 0.41034 4.19162
91 1RYD GLC 0.007277 0.44825 4.25
92 4B9E FAH 0.01789 0.43456 4.25
93 1MZV AMP 0.02989 0.40133 4.25532
94 2VHL GLP 0.03599 0.41221 4.29293
95 3HF3 FMN 0.006415 0.40144 4.29799
96 4K30 NLG 0.0327 0.40731 4.375
97 1ZED PNP 0.03319 0.42087 4.38596
98 3RGG AIR 0.02985 0.40135 4.40252
99 2Q37 3AL 0.00514 0.44976 4.41989
100 2JBH 5GP 0.001912 0.45837 4.44444
101 3I6B KDO 0.00509 0.44453 4.44444
102 3DGB MUC 0.001264 0.45571 4.45026
103 2F59 INI 0.009288 0.40486 4.4586
104 1P72 THM 0.02887 0.40982 4.49102
105 1HFA PIO 0.000442 0.53435 4.49827
106 3I8P 840 0.01777 0.4004 4.5
107 3MD0 GDP 0.006453 0.43488 4.50704
108 3O7B SAH 0.009595 0.40432 4.5082
109 2Q8M AMP 0.001411 0.45371 4.51807
110 2OWZ CIT 0.02243 0.42427 4.51807
111 1V6A TRE 0.02293 0.41894 4.51807
112 2OWZ F6P 0.007205 0.41249 4.51807
113 3W54 RNB 0.01056 0.41309 4.55927
114 1OGD RIP 0.03371 0.40669 4.58015
115 2Y7P SAL 0.003361 0.45279 4.58716
116 3ZF8 GDP 0.03021 0.40113 4.59016
117 3D2Y AH0 ALA FGA LYS 0.001497 0.43495 4.5977
118 1AX2 NDG GAL 0.03953 0.40347 4.60251
119 1GJW MAL 0.0009539 0.46615 4.67836
120 2C5S AMP 0.003219 0.44832 4.67836
121 1U5R ATP 0.00804 0.4142 4.67836
122 2EB5 OXL 0.01259 0.4366 4.86891
123 1WRA PC 0.006997 0.45523 4.87013
124 2XNJ FAD 0.03704 0.40897 4.88722
125 3QDT A2G GAL 0.01948 0.43859 4.8951
126 3QDY CBS 0.0234 0.42863 4.8951
127 1C3V PDC 0.01157 0.43307 4.89796
128 2P69 PLP 0.01545 0.42711 4.90196
129 2PFC PLM 0.00429 0.43341 4.91803
130 3ZPG 5GP 0.0003308 0.54141 4.97076
131 3P7I P7I 0.001292 0.47179 4.98442
132 2X7J TPP 0.007556 0.41154 5
133 3K5X P8D 0.02002 0.40894 5
134 4HZO COA 0.006741 0.43893 5.03145
135 1QH9 LAC 0.01234 0.43701 5.17241
136 1QY1 PRZ 0.00314 0.41572 5.17241
137 2P4Q FLC 0.03206 0.41661 5.25
138 2BO4 FLC 0.005378 0.461 5.26316
139 3NNF AKG 0.008664 0.44454 5.26316
140 1WDA BAG 0.01814 0.41484 5.26316
141 3K3G MMU 0.003469 0.45494 5.29412
142 2WK1 SAH 0.008305 0.40041 5.31915
143 2Z9V PXM 0.001164 0.47386 5.35714
144 3CQ5 PMP 0.01708 0.416 5.42005
145 3QV9 QV7 0.006999 0.44342 5.5
146 4EPL JAI 0.006861 0.41695 5.5
147 4WVH ASP HIS ASP ALA HIS ALA 0.03211 0.40369 5.5
148 1I7L ATP 0.004789 0.40292 5.50162
149 1PX8 XYP 0.004671 0.45172 5.55556
150 1H16 PYR 0.02298 0.4348 5.55556
151 2PUL ACP 0.009801 0.41076 5.55556
152 2O2C G6Q 0.01755 0.40062 5.55556
153 3QP6 HL6 0.0049 0.42677 5.66038
154 1DXY COI 0.005894 0.47346 5.70571
155 1EYE PMM 0.01424 0.41145 5.71429
156 2DVZ GLU 0.01183 0.41887 5.73248
157 2UZ1 TPP 0.001748 0.43858 5.75
158 3IAE D7K 0.005123 0.40628 5.75
159 2ZYF AKG 0.001021 0.47047 5.75916
160 4J7H TLO 0.003601 0.41356 5.84795
161 2GND MAN MMA 0.04399 0.41489 5.95238
162 2PHW MAN MAN 0.04841 0.41254 5.95238
163 3F81 STT 0.02877 0.43582 6.01093
164 3SHR CMP 0.0004182 0.4816 6.02007
165 3A1I UNU 0.007659 0.42705 6.14035
166 4C2G ALA ALA ALA ALA 0.01458 0.41908 6.14035
167 3UER TUR 0.01303 0.41308 6.14035
168 3UER BTU 0.01303 0.41308 6.14035
169 1QD0 RR6 0.026 0.40037 6.25
170 2VPR TDC 0.01148 0.40801 6.28019
171 1QDS PGA 0.0128 0.41737 6.3745
172 2GWD GLU 0.0004703 0.48543 6.43275
173 2WGC SIA GAL BGC 0.0495 0.43636 6.43275
174 1WGC SIA GAL BGC 0.03769 0.43599 6.43275
175 2YFT DQR 0.00432 0.42497 6.43275
176 1C7S CBS 0.02088 0.40441 6.43275
177 2FH5 GTP 0.01016 0.40023 6.48649
178 1F3L SAH 0.006964 0.40018 6.54206
179 3T2W BTN 0.01841 0.41052 6.55738
180 1BTN I3P 0.009896 0.48151 6.60377
181 1W7J ADP BEF 0.001726 0.43663 6.62252
182 3CEV ARG 0.02114 0.41186 6.68896
183 4IXW IXW 0.02238 0.41075 6.69291
184 4UAL 3FV 0.007713 0.41134 6.72515
185 4JRB PGT 0.01566 0.4097 6.75
186 3KMZ EQO 0.002925 0.40149 6.76692
187 1T0I FMN 0.001469 0.43526 6.80628
188 3RF4 FUN 0.02195 0.41533 6.89655
189 4KOA NDP 0.006894 0.41324 6.90691
190 3AHC TPP 0.0000003457 0.46861 7
191 1KTC NGA 0.0161 0.42155 7
192 2IZ1 ATR 0.0211 0.42558 7.01754
193 4M7F BM3 0.02779 0.41059 7.07965
194 4E28 0MZ 0.004618 0.45196 7.25
195 1EB9 HBA 0.008009 0.422 7.25191
196 3E81 SLB 0.01706 0.42506 7.31707
197 1N9L FMN 0.00247 0.42671 7.33945
198 1YRX FMN 0.01765 0.40392 7.43802
199 3CF6 SP1 0.01519 0.40313 7.5
200 3SQG COM 0.009306 0.47069 7.60234
201 3BK2 U5P 0.001362 0.45435 7.60234
202 1FBL HTA 0.006352 0.43057 7.75
203 1I1Q TRP 0.007433 0.43214 7.8125
204 2FGQ MLT 0.02659 0.42063 7.83133
205 4PTZ FMN 0.005663 0.41656 7.8534
206 2XDQ MGX 0.00757 0.46754 7.89474
207 4AF5 CIT 0.01056 0.44033 7.89474
208 3M31 FAD 0.002409 0.41324 7.89474
209 2V5E SCR 0.0127 0.46301 7.92079
210 1C1L GAL BGC 0.008636 0.4506 8.0292
211 2IYG FMN 0.01588 0.40945 8.06452
212 3P0F BAU 0.006583 0.41767 8.08081
213 3U1T MLI 0.002213 0.48048 8.09062
214 1MXI SAH 0.01143 0.40142 8.125
215 2YIV NBN 0.01205 0.44328 8.18713
216 1H8P PC 0.003895 0.48325 8.25688
217 1B4P GPS 0.004864 0.41554 8.29493
218 1T3D CYS 0.005836 0.45921 8.3045
219 2DWU DGL 0.01329 0.42089 8.33333
220 3E5P PPI 0.003918 0.50481 8.35579
221 1XX6 ADP 0.0153 0.41402 8.37696
222 3KJQ B94 0.005499 0.42887 8.42105
223 2OFE NAG 0.01927 0.42751 8.4507
224 3PMD 11A 0.003804 0.4402 8.49673
225 4P9Z NMI PTR 02K ASN NH2 0.003739 0.45066 8.54701
226 3KYF 5GP 5GP 0.01427 0.41533 8.65801
227 1ULE GLA GAL NAG 0.01263 0.44849 8.66667
228 1I0Z OXM 0.005932 0.47331 8.70871
229 4G28 0W8 0.01336 0.42078 8.72483
230 3GTD MLI 0.0381 0.40839 8.77193
231 1LYX PGA 0.004957 0.42657 8.87097
232 1B5E DCM 0.006544 0.43461 8.94309
233 1Y7P RIP 0.0473 0.40821 8.96861
234 2CE7 ADP 0.001766 0.44491 9
235 4E1M TQ2 0.02079 0.40822 9.03614
236 1SS4 CIT 0.000008445 0.70069 9.15033
237 1SS4 GSH 0.001143 0.53464 9.15033
238 2BZ1 TAU 0.003095 0.50816 9.18367
239 1W3R PYR 0.01095 0.45175 9.25926
240 2QLX RM4 0.01297 0.44165 9.25926
241 4JWX 1N4 0.001581 0.46778 9.28571
242 3LTW HLZ 0.007899 0.4465 9.28571
243 1MQ0 BRD 0.007862 0.41835 9.28571
244 3S9K CIT 0.004935 0.50391 9.32203
245 1VQ2 DDN 0.0129 0.40263 9.32642
246 1H8G CHT 0.005453 0.49358 9.47368
247 4WBD ADP 0.006472 0.45694 9.5
248 3L6R MLI 0.003313 0.47163 9.53757
249 1ZZ7 S0H 0.01157 0.42815 9.59596
250 1R6W 164 0.01376 0.40486 9.62733
251 3I51 45C 0.003999 0.43469 9.62963
252 2O66 FLC 0.01224 0.43192 9.62963
253 2GJN FMN 0.002935 0.40427 9.75
254 2JC9 ADN 0.04488 0.40089 9.94152
255 3T1A 5MA 0.01141 0.40146 10
256 3U7Y FLC 0.04141 0.44323 10.0437
257 1GU3 BGC BGC BGC BGC BGC 0.01844 0.41882 10.0671
258 1ECM TSA 0.001372 0.46478 10.0917
259 1Q3P GLU ALA GLN THR ARG LEU 0.007776 0.41478 10.0917
260 3MAG 3MA 0.04834 0.42974 10.0977
261 2Q1A 2KT 0.004107 0.46038 10.2389
262 4DN8 BMA 0.0413 0.41115 10.2564
263 1NU4 MLA 0.00791 0.484 10.3093
264 3MCT 3MC 0.01629 0.42131 10.4377
265 3R51 MMA 0.0008286 0.51976 10.625
266 1YOA FMN 0.009699 0.47874 10.6918
267 2ZWS PLM 0.01616 0.46555 10.8187
268 1JGS SAL 0.0003385 0.56503 10.8696
269 2FR6 CTN 0.007361 0.4087 10.9589
270 2FR6 URI 0.01197 0.40067 10.9589
271 4F8L GAL 0.02159 0.45804 11.0345
272 2ZJ5 ADP 0.005128 0.44981 11.1111
273 1F5F DHT 0.002513 0.43029 11.2195
274 1Y2W NAG 0.0224 0.4243 11.2676
275 4JP3 CIT 0.002746 0.44156 11.2971
276 1NNS ASP 0.01322 0.41677 11.3497
277 1SC3 MLI 0.04868 0.41747 11.3636
278 2XI7 XI7 0.0005262 0.55369 11.413
279 2BOI MFU 0.02225 0.41506 11.5044
280 3SCH TB6 0.006076 0.45207 11.6162
281 3KMT SAH 0.01731 0.40426 11.7647
282 3SIX GDP 0.002505 0.44324 11.8182
283 1JAC AMG 0.00265 0.50163 12.0301
284 2BES RES 0.01464 0.41095 12.2093
285 4EXO PYR 0.03106 0.42787 12.3288
286 3EW2 BTN 0.003587 0.44623 12.5926
287 4B4D FAD 0.00165 0.42582 12.9771
288 4WX0 HXD 0.009213 0.41183 13.308
289 5D63 FUC GAL GLA 0.02148 0.41155 13.3106
290 3MTW M3R 0.005864 0.41968 13.5
291 2W8Q SIN 0.007662 0.45323 13.7427
292 1UW1 ADP 0.03919 0.4078 13.75
293 3WCS MAN NAG 0.007521 0.43675 13.7795
294 3WCS MAN NAG GAL 0.01047 0.42116 13.7795
295 3NOJ PYR 0.01858 0.42095 13.8655
296 1QO0 BMD 0.004851 0.45685 14.2857
297 4L6C 0BT 0.005251 0.40452 14.3564
298 1Y75 NAG 0.002529 0.45297 14.4068
299 2VQ5 HBA 0.01883 0.43343 14.4279
300 2VQ5 LDP 0.04714 0.42395 14.4279
301 1UPA TPP 0.009529 0.40725 14.5
302 3W8S GSH 0.005028 0.45021 14.5631
303 1X92 M7P 0.00293 0.44037 14.5729
304 2E1A MSE 0.01474 0.41887 14.6667
305 2HFK E4H 0.008479 0.43436 14.7335
306 1Y1A GSH 0.001615 0.52544 14.7541
307 4JCA CIT 0.04053 0.43417 14.9701
308 4NTX AMR 0.01661 0.42322 15
309 3UEC ALA ARG TPO LYS 0.02 0.4321 15.0685
310 3GM5 CIT 0.008547 0.44483 15.0943
311 3WUD GLC GAL 0.01638 0.44255 15.4412
312 3SJ0 DXC 0.04283 0.41517 15.493
313 2VKL MLT 0.03917 0.43502 15.5556
314 1R9J TPP 0.0005673 0.46639 15.75
315 1PTR PRB 0.01385 0.44021 16
316 1SQ5 ADP 0.008925 0.42002 16
317 2DTJ THR 0.01488 0.41454 16.2921
318 4RJK PYR 0.006795 0.48792 16.3743
319 4RJK TPP 0.002425 0.42685 16.3743
320 4RJK TDL 0.00243 0.42151 16.3743
321 1ITZ TPP 0.0004849 0.46939 16.5
322 3KP6 SAL 0.04525 0.41484 16.5563
323 2YIC TPP 0.00001751 0.5148 16.6667
324 3PXP MYR 0.01067 0.40583 16.7808
325 3NCQ ATP 0.007439 0.40215 16.8067
326 3CH5 GDP 0.01972 0.40546 17.3077
327 2YLD CMO 0.03782 0.41305 17.3228
328 1T0S BML 0.009353 0.45535 17.4419
329 3PNA CMP 0.01379 0.42017 17.5325
330 1A27 EST 0.006145 0.41886 18
331 2HV8 GTP 0.001871 0.41382 18.75
332 2PR5 FMN 0.0003556 0.45862 18.9394
333 3BY8 MLT 0.001125 0.49529 19.0141
334 4NC7 I3C 0.0329 0.42106 19.1919
335 1TUV VK3 0.03689 0.42986 19.2982
336 1RP7 TZD 0.000009657 0.52983 20
337 4CCO OGA 0.02621 0.41177 20
338 2FYU FDN 0.001199 0.43861 20.5128
339 4F4S EFO 0.009757 0.43156 22.3684
340 4GO7 THR 0.0318 0.40015 22.5
341 2FOI JPA 0.02054 0.40845 22.6766
342 3PMA SCR 0.02686 0.41127 24.1379
343 4KXV TDP DX5 0.0000004557 0.53493 24.8538
344 1EZV SMA 0.003177 0.40032 25.6
345 1DL7 NCH 0.02252 0.45694 26.7857
346 1H2K OGA 0.005357 0.45475 26.8293
347 3KPE TM3 0.03402 0.41533 31.3725
348 4NM5 ADP 0.006767 0.40062 33.3333
349 5RHN 8BR 0.008927 0.41238 33.913
350 4CCN OGA 0.009842 0.44183 40
351 1UO5 PIH 0.002374 0.51498 41.1765
352 1UO4 PIH 0.01352 0.46147 41.1765
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