Receptor
PDB id Resolution Class Description Source Keywords
3CKZ 1.9 Å EC: 3.2.1.18 N1 NEURAMINIDASE H274Y + ZANAMIVIR INFLUENZA A VIRUS N1 NEURAMINIDASE H274Y ZANAMIVIR GLYCOSIDASE HYDROLASEMEMBRANE TRANSMEMBRANE VIRION VIRAL PROTEIN
Ref.: CRYSTAL STRUCTURES OF OSELTAMIVIR-RESISTANT INFLUENZA VIRUS NEURAMINIDASE MUTANTS. NATURE V. 453 1258 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:1;
Part of Protein;
none;
submit data
40.078 Ca [Ca+2...
ZMR A:469;
Valid;
none;
Ki = 0.19 nM
332.31 C12 H20 N4 O7 CC(=O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3CKZ 1.9 Å EC: 3.2.1.18 N1 NEURAMINIDASE H274Y + ZANAMIVIR INFLUENZA A VIRUS N1 NEURAMINIDASE H274Y ZANAMIVIR GLYCOSIDASE HYDROLASEMEMBRANE TRANSMEMBRANE VIRION VIRAL PROTEIN
Ref.: CRYSTAL STRUCTURES OF OSELTAMIVIR-RESISTANT INFLUENZA VIRUS NEURAMINIDASE MUTANTS. NATURE V. 453 1258 2008
Members (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 25 families.
1 2HU4 - G39 C14 H24 N2 O4 CCC(CC)O[C....
2 3TI6 ic50 = 0.54 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
3 3TI3 ic50 = 1.83 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
4 3TI5 ic50 = 1.11 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
5 3CL0 Ki = 20.8 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
6 4B7R Ki = 0.23 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
7 3TI4 ic50 = 947 nM LVO C21 H36 N4 O8 [H]/N=C(N)....
8 2HTY - NAG C8 H15 N O6 CC(=O)N[C@....
9 3CKZ Ki = 0.19 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
10 3B7E - ZMR C12 H20 N4 O7 CC(=O)N[C@....
70% Homology Family (28)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 21 families.
1 2HTQ - ZMR C12 H20 N4 O7 CC(=O)N[C@....
2 2HT5 - NDG C8 H15 N O6 CC(=O)N[C@....
3 3O9J - RP6 C14 H21 N O8 CC(=O)N[C@....
4 2HTU - BCZ C15 H28 N4 O4 CCC(CC)[C@....
5 4D8S ic50 = 0.32 uM 0HX C13 H21 N O6 CCC(CC)O[C....
6 2HTR - DAN C11 H17 N O8 CC(=O)N[C@....
7 3O9K - ETT C21 H27 N O8 Cc1ccc(cc1....
8 4M3M - 22N C14 H24 N2 O4 CCC(CC)O[C....
9 4KS4 Ki = 72 nM 1SN C19 H30 N4 O5 CC[C@H](c1....
10 4KS1 Kd = 1.5 nM 2H8 C14 H24 N2 O4 CCC(CC)O[C....
11 4MJU - 27S C16 H23 N3 O5 S CCC(CC)O[C....
12 2HT8 - G39 C14 H24 N2 O4 CCC(CC)O[C....
13 4WA5 ic50 = 1.29 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
14 4WA4 ic50 = 0.66 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
15 4QN5 - SIA GAL n/a n/a
16 3SAN - ZMR C12 H20 N4 O7 CC(=O)N[C@....
17 3TI8 ic50 = 0.9 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
18 2HU4 - G39 C14 H24 N2 O4 CCC(CC)O[C....
19 3TI6 ic50 = 0.54 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
20 3TI3 ic50 = 1.83 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
21 3TI5 ic50 = 1.11 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
22 3CL0 Ki = 20.8 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
23 4B7R Ki = 0.23 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
24 3TI4 ic50 = 947 nM LVO C21 H36 N4 O8 [H]/N=C(N)....
25 2HTY - NAG C8 H15 N O6 CC(=O)N[C@....
26 3CKZ Ki = 0.19 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
27 3B7E - ZMR C12 H20 N4 O7 CC(=O)N[C@....
28 4B7J Ki = 11.1 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
50% Homology Family (103)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 14 families.
1 2HTQ - ZMR C12 H20 N4 O7 CC(=O)N[C@....
2 2HT5 - NDG C8 H15 N O6 CC(=O)N[C@....
3 3O9J - RP6 C14 H21 N O8 CC(=O)N[C@....
4 2HTU - BCZ C15 H28 N4 O4 CCC(CC)[C@....
5 4D8S ic50 = 0.32 uM 0HX C13 H21 N O6 CCC(CC)O[C....
6 2HTR - DAN C11 H17 N O8 CC(=O)N[C@....
7 3O9K - ETT C21 H27 N O8 Cc1ccc(cc1....
8 4M3M - 22N C14 H24 N2 O4 CCC(CC)O[C....
9 4KS4 Ki = 72 nM 1SN C19 H30 N4 O5 CC[C@H](c1....
10 4KS1 Kd = 1.5 nM 2H8 C14 H24 N2 O4 CCC(CC)O[C....
11 4MJU - 27S C16 H23 N3 O5 S CCC(CC)O[C....
12 2HT8 - G39 C14 H24 N2 O4 CCC(CC)O[C....
13 1F8E Ki = 15 uM 49A C11 H19 N3 O6 CC(=O)N[C@....
14 4MWW - G39 C14 H24 N2 O4 CCC(CC)O[C....
15 2QWG ic50 = 230 uM G28 C13 H23 N3 O5 CCN(CC)C(=....
16 1INY - EQP C10 H20 N O9 P CC(=O)N[C@....
17 1F8B Ki = 4 uM DAN C11 H17 N O8 CC(=O)N[C@....
18 1XOE ic50 = 41 nM ABX C14 H24 N2 O5 CC(C)C[C@@....
19 4MWX ic50 = 75.7 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
20 2QWC Ki = 280 uM DAN C11 H17 N O8 CC(=O)N[C@....
21 2QWJ ic50 = 0.23 uM G28 C13 H23 N3 O5 CCN(CC)C(=....
22 2QWI Ki = 2.16 uM G20 C14 H23 N5 O5 [H]/N=C(/N....
23 4MWY ic50 = 89.6 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
24 1L7G - BCZ C15 H28 N4 O4 CCC(CC)[C@....
25 1BJI ic50 = 0.002 uM DPC C20 H27 N3 O5 CCCN(CCc1c....
26 1F8D Ki = 400 uM 9AM C11 H18 N2 O7 CC(=O)N[C@....
27 2QWE Ki = 0.033 uM GNA C12 H22 N4 O7 CC(=O)N[C@....
28 4MWQ ic50 = 0.79 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
29 1NNC - ZMR C12 H20 N4 O7 CC(=O)N[C@....
30 4MX0 ic50 = 184.7 nM BCZ C15 H28 N4 O4 CCC(CC)[C@....
31 2QWB Ki = 1820 uM SIA C11 H19 N O9 CC(=O)N[C@....
32 2QWK ic50 = 0.002 uM G39 C14 H24 N2 O4 CCC(CC)O[C....
33 2QWF Ki = 2.16 uM G20 C14 H23 N5 O5 [H]/N=C(/N....
34 1MWE - SIA C11 H19 N O9 CC(=O)N[C@....
35 4MWR ic50 = 0.41 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
36 1L7F - BCZ C15 H28 N4 O4 CCC(CC)[C@....
37 1F8C Ki = 0.04 uM 4AM C11 H18 N2 O7 CC(=O)N[C@....
38 4MWU ic50 = 3.24 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
39 5JYY - 6PY C16 H27 N5 O9 [H]/N=C(N)....
40 2QWD Ki = 14 uM 4AM C11 H18 N2 O7 CC(=O)N[C@....
41 2QWH ic50 = 13 uM G39 C14 H24 N2 O4 CCC(CC)O[C....
42 4WEG - DF4 C11 H16 F N O8 CC(=O)N[C@....
43 4MWV ic50 = 0.4 nM BCZ C15 H28 N4 O4 CCC(CC)[C@....
44 4DGR ic50 = 4.4 uM 3LV C20 H30 N2 O5 CCCN(CCC)C....
45 1L7H - BCZ C15 H28 N4 O4 CCC(CC)[C@....
46 4GZP Ki = 14.3 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
47 4GZT Ki = 17 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
48 4GZX - SIA C11 H19 N O9 CC(=O)N[C@....
49 4GZW Kd = 30 uM NAG SIA GAL n/a n/a
50 4GZQ - SIA C11 H19 N O9 CC(=O)N[C@....
51 1INF ic50 = 10 uM ST4 C10 H14 N4 O3 CC(=O)Nc1c....
52 1B9T ic50 = 8 uM RAI C14 H18 N4 O5 c1cc(c(cc1....
53 1IVB - ST1 C9 H8 N2 O6 CC(=O)Nc1c....
54 1A4Q ic50 = 3.6 uM DPC C20 H27 N3 O5 CCCN(CCc1c....
55 1NSC - SIA C11 H19 N O9 CC(=O)N[C@....
56 1A4G ic50 = 0.004 uM ZMR C12 H20 N4 O7 CC(=O)N[C@....
57 1INV - EQP C10 H20 N O9 P CC(=O)N[C@....
58 1B9S ic50 = 667 uM FDI C15 H20 N2 O4 CCC(CC)C(=....
59 3K37 ic50 = 2.8 nM BCZ C15 H28 N4 O4 CCC(CC)[C@....
60 1VCJ ic50 = 26 uM IBA C18 H27 N3 O4 CCC(CC)Nc1....
61 1B9V ic50 = 224 uM RA2 C18 H26 N2 O5 CCC(CC)Nc1....
62 1NSD - DAN C11 H17 N O8 CC(=O)N[C@....
63 4H53 - SLB C11 H19 N O9 CC(=O)N[C@....
64 4K1I - G39 C14 H24 N2 O4 CCC(CC)O[C....
65 4K1J - G39 C14 H24 N2 O4 CCC(CC)O[C....
66 4K1K - G39 C14 H24 N2 O4 CCC(CC)O[C....
67 1ING - ST5 C11 H12 N2 O5 CC(=O)Nc1c....
68 1INH - ST6 C11 H14 N3 O4 CC(=O)Nc1c....
69 1IVF - DAN C11 H17 N O8 CC(=O)N[C@....
70 1IVE - ST3 C9 H10 N2 O3 CC(=O)Nc1c....
71 1INX - EQP C10 H20 N O9 P CC(=O)N[C@....
72 1INW - AXP C10 H20 N O9 P CC(=O)N[C@....
73 2BAT - SIA C11 H19 N O9 CC(=O)N[C@....
74 1IVC - ST2 C9 H10 N2 O4 CC(=O)Nc1c....
75 1IVD - ST1 C9 H8 N2 O6 CC(=O)Nc1c....
76 4QN6 - LNV C13 H22 N4 O7 [H]/N=C(N)....
77 4WA5 ic50 = 1.29 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
78 4WA4 ic50 = 0.66 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
79 4QN5 - SIA GAL n/a n/a
80 3SAN - ZMR C12 H20 N4 O7 CC(=O)N[C@....
81 3TI8 ic50 = 0.9 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
82 2HU4 - G39 C14 H24 N2 O4 CCC(CC)O[C....
83 3TI6 ic50 = 0.54 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
84 3TI3 ic50 = 1.83 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
85 3TI5 ic50 = 1.11 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
86 3CL0 Ki = 20.8 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
87 4B7R Ki = 0.23 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
88 3TI4 ic50 = 947 nM LVO C21 H36 N4 O8 [H]/N=C(N)....
89 2HTY - NAG C8 H15 N O6 CC(=O)N[C@....
90 3CKZ Ki = 0.19 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
91 3B7E - ZMR C12 H20 N4 O7 CC(=O)N[C@....
92 4CPN - ZMR C12 H20 N4 O7 CC(=O)N[C@....
93 4CPY Ki = 491.35 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
94 4CPZ Ki = 20.85 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
95 4B7J Ki = 11.1 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
96 4QN7 ic50 = 0.84 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
97 3TIC ic50 = 1.36 nM ZMR C12 H20 N4 O7 CC(=O)N[C@....
98 3TIA ic50 = 3.12 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
99 3TIB ic50 = 129 nM LVO C21 H36 N4 O8 [H]/N=C(N)....
100 4HZZ ic50 = 8.31 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
101 4I00 - ZMR C12 H20 N4 O7 CC(=O)N[C@....
102 4HZW ic50 = 1.31 nM LNV C13 H22 N4 O7 [H]/N=C(N)....
103 4HZX ic50 = 0.5 nM G39 C14 H24 N2 O4 CCC(CC)O[C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ZMR; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 ZMR 1 1
2 4AM 0.615385 0.865385
3 DAN 0.590909 0.792453
4 49A 0.478873 0.830189
5 9AM 0.472222 0.796296
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3CKZ; Ligand: ZMR; Similar sites found: 332
This union binding pocket(no: 1) in the query (biounit: 3ckz.bio1) has 21 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3KPE TM3 0.01756 0.42689 None
2 2E1A MSE 0.0118 0.42051 None
3 3E5H GNP 0.002397 0.40724 None
4 4WBD CIT 0.01841 0.43728 1.03896
5 1N6B DMZ 0.00007276 0.4165 1.03896
6 4WBD ADP 0.04488 0.41169 1.03896
7 3DER ALA LYS 0.005202 0.40821 1.15942
8 4MOB ADP 0.0002423 0.46891 1.20482
9 3UXL CFI 0.0000006992 0.45417 1.30548
10 3NFZ 3NF 0.009907 0.4154 1.52905
11 2Q3M MLA 0.01837 0.44392 1.53374
12 4E28 9MZ 0.04463 0.40703 1.53846
13 4G1V FAD 0.0004781 0.41999 1.55844
14 4HZO COA 0.04148 0.40004 1.57233
15 1JH7 UVC 0.01205 0.42956 1.5873
16 1JQ5 NAD 0.001663 0.41571 1.62162
17 1AL8 FMN 0.000006521 0.40865 1.67131
18 1U5R ATP 0.01333 0.40275 1.72414
19 3TKA CTN 0.01116 0.4618 1.72911
20 2ZWS PLM 0.007463 0.48274 1.81818
21 1Q3Q ANP 0.000001132 0.46695 1.81818
22 2GWD GLU 0.001061 0.46664 1.81818
23 1PEA ACM 0.008194 0.45562 1.81818
24 2Z9V PXM 0.007712 0.4335 1.81818
25 4P87 4NP 0.0004004 0.42615 1.81818
26 4IU0 ABH 0.00163 0.41946 1.81818
27 2NVK NAP 0.016 0.41905 1.81818
28 4LIT AKG 0.02211 0.41713 1.81818
29 1ZFJ IMP 0.0007417 0.41512 1.81818
30 3OH3 UAD 0.009696 0.40393 1.81818
31 4NM5 ADP 0.004304 0.40473 1.85676
32 1YOE RIB 0.0000001864 0.44033 1.86335
33 4TMK T5A 0.000736 0.4206 1.87793
34 4N02 FNR 0.000006903 0.44248 1.96078
35 1UF5 CDT 0.02014 0.40624 1.9802
36 4LTN NAI 0.0001278 0.40639 2.03046
37 1IZC PYR 0.001655 0.41923 2.0649
38 1Z42 FMN 0.009397 0.41636 2.07101
39 1NVU GTP 0.00000265 0.45526 2.07792
40 2BO4 FLC 0.007997 0.44955 2.07792
41 1TV5 ORO 0.001676 0.43621 2.07792
42 3B9Z CO2 0.01366 0.4322 2.07792
43 4IVG ANP 0.00003397 0.42287 2.07792
44 4C6F NCD 0.009627 0.42004 2.07792
45 4C6F DOR 0.009627 0.42004 2.07792
46 1ZED PNP 0.03119 0.41974 2.07792
47 1TV5 A26 0.001994 0.41641 2.07792
48 3A1I UNU 0.01711 0.40929 2.07792
49 1Y9Q MED 0.007046 0.44616 2.08333
50 4O8O AHR 0.002344 0.41495 2.08333
51 3NOJ PYR 0.003105 0.45428 2.10084
52 3FPZ AHZ 0.00002239 0.44876 2.14724
53 1Q11 TYE 0.006086 0.43818 2.15054
54 1G8S MET 0.01119 0.43641 2.17391
55 1WKL ADP 0.000163 0.46804 2.18978
56 1WKL ATP 0.008968 0.40272 2.18978
57 1LTH NAD 0.0001496 0.40867 2.19436
58 1J2Z SOG 0.01385 0.40041 2.22222
59 3U1T MLI 0.0003142 0.51991 2.26537
60 1X1T NAD 0.0005468 0.40689 2.30769
61 3L6R MLI 0.0184 0.43134 2.31214
62 2XDQ MGX 0.009365 0.45979 2.33766
63 4OYA 1VE 0.00004251 0.4515 2.33766
64 1JQN DCO 0.00001447 0.44838 2.33766
65 4LCQ URQ 0.00009916 0.43816 2.33766
66 4QDC ASD 0.0002058 0.43361 2.33766
67 4LHM AZZ 0.01426 0.42612 2.33766
68 1UOU CMU 0.005221 0.42283 2.33766
69 1GJW GLC 0.03075 0.42006 2.33766
70 1HV9 UD1 0.0003394 0.41266 2.33766
71 1GJW MAL 0.02135 0.40514 2.33766
72 2CE7 ADP 0.01774 0.40122 2.33766
73 3I0O SMI 0.00977 0.43385 2.35988
74 1OMZ UD2 0.000008022 0.4313 2.38908
75 2GGH NLQ 0.00007164 0.42258 2.4
76 1LDM NAD 0.00008457 0.42393 2.43161
77 3DG6 MUC 0.01016 0.41108 2.45232
78 4JEJ 1GP 0.01432 0.40871 2.45902
79 3EJ0 11X 0.001063 0.47573 2.55102
80 1JA9 NDP 0.00001488 0.44727 2.55474
81 2ORV 4TA 0.002488 0.40669 2.5641
82 2NZ2 ASP 0.0003104 0.49682 2.5974
83 2NZ2 CIR 0.000002678 0.49558 2.5974
84 3L24 GOA 0.002935 0.48701 2.5974
85 1PX8 XYP 0.01472 0.42548 2.5974
86 1V5F FAD 0.002105 0.41705 2.5974
87 1V5F TPP 0.002105 0.41705 2.5974
88 1YBH FAD 0.0004839 0.41592 2.5974
89 3V1V GST 0.005323 0.4148 2.5974
90 3PLN U5P 0.02521 0.41 2.5974
91 1V8K ANP 0.0005634 0.40915 2.5974
92 1E5F PLP 0.01179 0.40487 2.5974
93 1QPB PYM 0.001862 0.40484 2.5974
94 4C2G ALA ALA ALA ALA 0.02714 0.40445 2.5974
95 3DGB MUC 0.01867 0.40388 2.5974
96 4Q3S X7A 0.001934 0.40287 2.5974
97 4J7H TRH 0.007525 0.40233 2.5974
98 2EB5 OXL 0.006472 0.44795 2.62172
99 4AF5 CIT 0.01609 0.42875 2.63158
100 4B9E FAH 0.01531 0.43536 2.65781
101 2OWZ CIT 0.01035 0.43807 2.71084
102 2Q8M AMP 0.007617 0.42017 2.71084
103 2OWZ F6P 0.01237 0.40066 2.71084
104 3P7I P7I 0.007761 0.43337 2.80374
105 2OFE NAG 0.01154 0.43576 2.8169
106 2OFD NGA 0.0335 0.41317 2.8169
107 2Y7G AAE 0.005367 0.4184 2.83688
108 4N7C AEF 0.04122 0.41357 2.84091
109 3VCA PRO 0.003513 0.4518 2.85714
110 1VCO GLN 0.000132 0.44154 2.85714
111 1E4I NFG 0.001332 0.40949 2.85714
112 3WAS BGC BMA 0.0004448 0.40928 2.85714
113 4UAL 3FV 0.008028 0.40792 2.85714
114 3CXO 3LR 0.000007979 0.40387 2.85714
115 2ZX7 ZX7 0.001028 0.40285 2.85714
116 4W6Z ETF 0.02453 0.43708 2.88184
117 3W8S GSH 0.009229 0.43501 2.91262
118 1ML4 PAL 0.00009521 0.46942 2.92208
119 1SQ5 PAU 0.02766 0.40816 2.92208
120 2WL9 MBD 0.0004702 0.43085 2.95082
121 3ZF8 GDP 0.00778 0.42401 2.95082
122 1FNZ A2G 0.00006601 0.46808 2.95359
123 1RZM PEP 0.01191 0.42491 2.95858
124 1RZM E4P 0.04913 0.40967 2.95858
125 1MZV AMP 0.003141 0.44089 2.97872
126 9LDT OXM 0.04189 0.43088 3.01205
127 1T0S BML 0.002592 0.4816 3.0303
128 1WVC CTP 0.000103 0.43331 3.0888
129 1JCM 137 0.0006949 0.4123 3.0888
130 1WDA BAG 0.006611 0.43163 3.11688
131 1KTC NGA 0.03388 0.4041 3.11688
132 3WN0 FUB 0.004734 0.40336 3.11688
133 3GJB AKG 0.0009055 0.46967 3.1348
134 1JSH SIA GAL 0.0009938 0.42697 3.1348
135 3MB5 SAM 0.000002992 0.44934 3.13725
136 3VOZ 04A 0.0001016 0.48092 3.1746
137 2C1Q BTN 0.0001611 0.40227 3.1746
138 1I9G SAM 0.00001943 0.42438 3.21429
139 2R5T ANP 0.004188 0.40833 3.21716
140 1WRA PC 0.01011 0.44444 3.24675
141 4FUA PGH 0.0000797 0.44854 3.25581
142 2YDW WSH 0.01627 0.41023 3.26797
143 1UCN ADP 0.008145 0.41498 3.28947
144 4Q0A GLY HIS LYS ILE LEU HIS ARG LEU LEU GLN 0.007706 0.40519 3.31126
145 4L7I SAM 0.003435 0.42213 3.37662
146 3RO7 TDR 0.0002138 0.42987 3.39623
147 1O9U ADZ 0.01371 0.45081 3.42857
148 3OCZ SRA 0.008163 0.40764 3.43511
149 1GSA ADP 0.000003037 0.44675 3.48101
150 1GSA GSH 0.0001189 0.40045 3.48101
151 4M7F BM3 0.002602 0.45494 3.53982
152 4IXW IXW 0.007642 0.42885 3.54331
153 1B55 4IP 0.005105 0.42322 3.5503
154 2BZ1 TAU 0.00491 0.49346 3.57143
155 1EXB NDP 0.0001231 0.42428 3.61446
156 1GPJ CIT 0.007775 0.44409 3.63636
157 2O2C G6Q 0.009316 0.40892 3.63636
158 2ZI8 SDT 0.0000414 0.44977 3.66667
159 2O66 FLC 0.03378 0.4084 3.7037
160 4K30 NLG 0.01545 0.4112 3.75
161 1YOA FMN 0.02608 0.45058 3.77358
162 3QP6 HL6 0.008158 0.41496 3.77358
163 1F8F NAD 0.0002199 0.40627 3.77358
164 2OHV NHL 0.03141 0.40162 3.78788
165 2GN2 C5P 0.00006478 0.48843 3.80117
166 2J5S KTA 0.00007548 0.48057 3.80228
167 3DX5 DHB 0.008745 0.42183 3.84615
168 2Z5Y HRM 0.0002242 0.42733 3.8961
169 1SS4 CIT 0.001384 0.52227 3.92157
170 1SS4 GSH 0.03812 0.44116 3.92157
171 1A8S PPI 0.003773 0.43515 4.0293
172 2HFK E4H 0.01387 0.42188 4.07523
173 1ZS6 ADP 0.02566 0.40554 4.14201
174 3BK2 U5P 0.00133 0.45173 4.15584
175 1I2B UPG 0.0004424 0.43111 4.15584
176 1I2B NAD 0.0004424 0.43111 4.15584
177 1I2B USQ 0.0004424 0.43111 4.15584
178 2YP9 SIA CMO 0.004267 0.42039 4.15584
179 1A59 CIT 0.02712 0.42283 4.2328
180 4IAE 1DX 0.00005397 0.4173 4.2328
181 1A59 COA 0.009794 0.40128 4.2328
182 3S9K CIT 0.0001987 0.56878 4.23729
183 3LTW HLZ 0.01928 0.42491 4.28571
184 2BGM NAJ 0.0002143 0.40833 4.31655
185 2BLE 5GP 0.00002412 0.43466 4.35967
186 1NXJ GLV 0.0002952 0.4911 4.37158
187 3F81 STT 0.003213 0.48489 4.37158
188 1NXJ TLA 0.0004343 0.45905 4.37158
189 1E4E ADP 0.00261 0.42286 4.37318
190 2YIV YIV 0.01257 0.44594 4.41558
191 3TFC PEP 0.005244 0.44112 4.41558
192 2IMP NAI 0.0001468 0.42643 4.41558
193 3ZGE ASP 0.04925 0.41477 4.41558
194 3O03 NAP 0.00003441 0.42878 4.46735
195 1Y7P RIP 0.01286 0.43347 4.4843
196 4B16 NAG 0.008774 0.46942 4.51128
197 5D6C 57S 0.03132 0.43128 4.54545
198 1C7S CBS 0.007828 0.41967 4.67532
199 3K3G MMU 0.005162 0.44409 4.70588
200 4PB2 5UD 0.001107 0.43684 4.71698
201 2Q1A 2KT 0.0002138 0.45027 4.77816
202 1CKM GTP 0.01773 0.41268 4.84848
203 2JBH 5GP 0.01004 0.42362 4.88889
204 3GM5 CIT 0.01114 0.43651 5.03145
205 4M5P MLA 0.003794 0.48992 5.19481
206 4QCK ASD 0.0001626 0.44237 5.19481
207 2PP3 LGT 0.0001871 0.43492 5.19481
208 3OIG NAD 0.00004179 0.42846 5.26316
209 3OIG IMJ 0.000005212 0.4195 5.26316
210 2BOI MFU 0.02586 0.4095 5.30973
211 2X61 NGA GAL SIA 0.000003211 0.45529 5.42636
212 2X61 CH 0.00001418 0.41958 5.42636
213 2BJF DXC 0.0000324 0.41405 5.47112
214 3RK0 AMP 0.01406 0.40903 5.48523
215 3E81 SLB 0.04515 0.40239 5.4878
216 2YLD CMO 0.021 0.4231 5.51181
217 2Y6P CTP 0.01906 0.40727 5.55556
218 2QV7 ADP 0.002843 0.4293 5.63798
219 1WNG SAH 0.002946 0.41727 5.66038
220 4NVP 7CH 0.000005274 0.42251 5.74163
221 3D2Y AH0 ALA FGA LYS 0.005077 0.41201 5.74713
222 3W54 RNB 0.0184 0.40057 5.77508
223 2GJ3 FAD 0.00005563 0.43653 5.83333
224 2WGC SIA GAL BGC 0.01977 0.45773 5.84795
225 1F7K UMP 0.001919 0.40297 5.88235
226 3KMZ EQO 0.00129 0.40993 5.97403
227 2F2U M77 0.02456 0.40251 5.97403
228 4Q3F TLA 0.0008571 0.49043 5.98291
229 1DXY COI 0.03981 0.42557 6.00601
230 1XX4 BAM 0.0009314 0.47836 6.13027
231 1O7N IND 0.003658 0.4072 6.18557
232 4WVH ASP HIS ASP ALA HIS ALA 0.03347 0.40038 6.23377
233 1A5Z OXM 0.0003008 0.53011 6.26959
234 1A5Z FBP 0.0002848 0.45441 6.26959
235 1G7V PAI 0.0001411 0.40371 6.33803
236 2ZSC BTN 0.01303 0.40669 6.38298
237 4B4D FAD 0.006825 0.40073 6.48855
238 1YBQ BDH 0.00006063 0.42454 6.49351
239 5A2J ALA PRO ASP THR ARG PRO 0.02664 0.43191 6.55738
240 2B7N NTM 0.03819 0.40586 6.59341
241 1NJR XYL 0.002023 0.40084 6.69014
242 4JP3 CIT 0.0001042 0.42423 6.69456
243 3HPF GAE 0.00005849 0.42496 6.75325
244 4A8H PUW 0.0004252 0.41423 6.76056
245 3UEC ALA ARG TPO LYS 0.02341 0.42606 6.84932
246 1EDO NAP 0.0001097 0.42412 6.96721
247 3O2K DST 0.006864 0.4358 7.01299
248 3O2K QRP 0.01573 0.41087 7.01299
249 4DN8 BMA 0.002356 0.4692 7.05128
250 1QO0 BMD 0.0166 0.42808 7.14286
251 2C5S AMP 0.005279 0.43595 7.27273
252 4M7J KDA KDO KDO 0.04076 0.41641 7.30594
253 2W24 LYS 0.00002492 0.45651 7.33333
254 3VGL BGC 0.0006456 0.41327 7.47664
255 3VGL ANP 0.0002363 0.40319 7.47664
256 2Q8H TF4 0.008744 0.4614 7.53247
257 4KCT PYR 0.002513 0.45016 7.53247
258 3CF6 SP1 0.004951 0.41978 7.53247
259 4KCT FDP 0.01648 0.40614 7.53247
260 1P1M MET 0.005577 0.40079 7.53247
261 2FR6 URI 0.006676 0.40754 7.53425
262 2FR6 CTN 0.009177 0.40234 7.53425
263 4F8L GAL 0.00911 0.47764 7.58621
264 1Y75 NAG 0.01988 0.41047 7.62712
265 1SJW NGV 0.0001335 0.40965 7.63889
266 3SHR CMP 0.001806 0.45118 7.69231
267 4PTZ FMN 0.01064 0.40319 7.8534
268 4LO6 SIA GAL 0.0006374 0.50877 7.89474
269 5DUB GLY 5GG GLY ALA 0.03336 0.42668 7.94393
270 1ULE GLA GAL NAG 0.02089 0.43441 8
271 2HVK TBA 0.0001897 0.52208 8.06452
272 1FX8 BOG 0.0002661 0.46485 8.18505
273 1ECM TSA 0.006363 0.43237 8.25688
274 1YRX FMN 0.002073 0.43909 8.26446
275 3NJQ NJQ 0.00005796 0.45295 8.29016
276 2PR5 FMN 0.001746 0.42941 8.33333
277 2QLX RM4 0.0362 0.41645 8.33333
278 2HNK SAH 0.008 0.40135 8.3682
279 5DRN 5CT 0.01131 0.45915 8.37209
280 3KMT SAH 0.01369 0.40581 8.40336
281 3KJQ B94 0.01566 0.40708 8.42105
282 2NLI LAC 0.00004259 0.42041 8.42391
283 2NLI FMN 0.00004259 0.42041 8.42391
284 4M51 BEZ 0.02676 0.42876 8.57143
285 4G28 0W8 0.01602 0.41463 8.72483
286 3CEV ARG 0.01008 0.42355 9.0301
287 1SC3 MLI 0.01639 0.43993 9.09091
288 1JGS SAL 0.00651 0.48624 9.42029
289 3CH5 GDP 0.01867 0.40388 9.61539
290 1CFV E3G 0.002028 0.4066 9.73451
291 3SJ0 DXC 0.04944 0.40953 9.85915
292 4AF0 MOA 0.00111 0.4184 9.87013
293 2Q37 3AL 0.02151 0.4177 9.94475
294 1LYX PGA 0.00653 0.41888 10.0806
295 3SCH TB6 0.005767 0.45038 10.101
296 1ZZ7 S0H 0.01838 0.41629 10.101
297 4JCA CIT 0.02146 0.44745 10.1796
298 2ZO9 MLI 0.000544 0.47063 10.219
299 1C1L GAL BGC 0.004174 0.46371 10.219
300 2VQ5 LDP 0.03496 0.42866 10.4478
301 3P3N AKG 0.01586 0.42905 10.6017
302 3ZZS TRP 0.00003653 0.4305 10.7692
303 4HE2 AMP 0.00002505 0.44882 10.9467
304 1NU4 MLA 0.01907 0.41127 11.3402
305 1H2M OGA 0.02683 0.4179 11.5385
306 3DUR KDO 0.04702 0.40155 11.5702
307 1H8G CHT 0.03946 0.43985 11.5789
308 2JFV FLC 0.007999 0.44349 11.6838
309 1T26 NAI 0.00003823 0.45039 11.8012
310 1T26 GBD 0.00003823 0.45039 11.8012
311 4F4S EFO 0.007343 0.43447 11.8421
312 1EB9 HBA 0.01768 0.40487 12.2137
313 2Y7P SAL 0.02153 0.41315 12.3853
314 3EW2 BTN 0.00807 0.42781 12.5926
315 1JN2 SFP 0.001214 0.4485 13.0802
316 1UW1 ADP 0.047 0.40156 13.75
317 3I8T LBT 0.000008553 0.56753 14.6341
318 1GU3 BGC BGC BGC BGC BGC 0.02829 0.4077 14.7651
319 1UGX GAL MGC 0.0001822 0.43008 15.0376
320 4G4S LDZ 0.009554 0.405 15.7447
321 1JOT GAL A2G 0.0001666 0.49544 15.7895
322 4NTX AMR 0.00734 0.43703 16.6667
323 3A2Y TS5 0.006363 0.41181 16.7513
324 3QDY CBS 0.005748 0.45674 16.7832
325 3QDY A2G GAL 0.01567 0.44094 16.7832
326 3QDT A2G GAL 0.01704 0.43904 16.7832
327 43CA NPO 0.03723 0.445 17.094
328 2HMT NAI 0.0001677 0.40346 18.0556
329 2FOI JPA 0.01054 0.41834 18.3333
330 1GXU 2HP 0.00499 0.40248 18.6813
331 2HV8 GTP 0.0002577 0.43956 26.5625
332 4CCO OGA 0.01846 0.41621 30
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