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Receptor
PDB id Resolution Class Description Source Keywords
3RIN 2.2 Å EC: 2.7.11.24 P38 KINASE CRYSTAL STRUCTURE IN COMPLEX WITH SMALL MOLECULE HOMO SAPIENS P38 MAP KINASE TRANSFERASE-TRANSFERASE INHIBITOR COMPLEX
Ref.: INDOLIN-2-ONE P38(ALPHA) INHIBITORS I: DESIGN, PROF CRYSTALLOGRAPHIC BINDING MODE. BIOORG.MED.CHEM.LETT. V. 21 4130 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
I2O A:401;
Valid;
none;
ic50 = 1.3 nM
360.449 C23 H24 N2 O2 Cc1cc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1OUK 2.5 Å EC: 2.7.11.24 THE STRUCTURE OF P38 ALPHA IN COMPLEX WITH A PYRIDINYLIMIDAZ INHIBITOR HOMO SAPIENS MAP KINASE HYDROPHOBIC POCKET KINASE DOMAIN ATP BINDING DTRANSFERASE
Ref.: STRUCTURAL BASIS FOR P38ALPHA MAP KINASE QUINAZOLIN PYRIDOL-PYRIMIDINE INHIBITOR SPECIFICITY NAT.STRUCT.BIOL. V. 10 764 2003
Members (153)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 16 families.
1 3GCV Kd = 74 nM SS6 C29 H30 N8 O Cc1cccc(c1....
2 3L8S Kd = 99 nM BFF C20 H24 Br F2 N5 O3 S c1c(cc(c(c....
3 3RIN ic50 = 1.3 nM I2O C23 H24 N2 O2 Cc1ccc(cc1....
4 5N65 - 8OT C20 H18 N4 S c1ccc(cc1)....
5 4FA2 - SB0 C20 H21 F N4 O2 COc1nccc(n....
6 2GHM - LIC C24 H28 Cl N5 O3 C[C@@H](C(....
7 1W84 ic50 = 35 uM L12 C15 H14 N2 c1ccc2c(c1....
8 4EH5 - IRG C17 H16 N4 c1ccc(cc1)....
9 2BAK Kd = 37 nM AQZ C32 H37 N7 O4 Cc1ccc(cc1....
10 3HV6 ic50 = 5500 nM R39 C27 H35 N5 O3 Cc1ccc(cc1....
11 3HP2 - P36 C19 H16 Br N O2 c1ccc(cc1)....
12 1WBO ic50 = 1 mM 2CH C6 H5 Cl O c1ccc(c(c1....
13 4KIQ ic50 = 23 nM 1RA C23 H23 N3 O4 CCOC(=O)n1....
14 3GC7 ic50 = 0.4 nM B45 C28 H27 Cl3 F N3 O CC(C)N1CCC....
15 4EH6 - IRG C17 H16 N4 c1ccc(cc1)....
16 5MTX Kd = 17.7 nM FJI C34 H31 F N4 O5 c1ccc(cc1)....
17 2ZB0 Ki = 0.24 uM GK3 C24 H18 N4 O2 Cc1ccc(cc1....
18 2GTM ic50 = 542 nM LID C19 H15 Cl F2 N6 CCn1c2c(cn....
19 5N66 - B96 C31 H37 N5 O3 Cc1ccc(cc1....
20 2YIX Kd = 3.3 nM YIX C19 H23 N5 O S CCNC(=O)NC....
21 3OCG ic50 = 3 nM OCG C21 H18 N6 O3 Cc1ccc(cc1....
22 1BL7 - SB4 C18 H19 F N6 c1cc(ccc1c....
23 3P7C ic50 = 0.022 uM P7C C25 H33 Cl2 N5 O3 S CC(C)(C)c1....
24 5TBE Kd = 4.4 nM 78L C33 H30 F2 N4 O4 S c1cc(sc1)C....
25 4KIP ic50 = 7 nM 1R9 C21 H18 Cl N3 O2 S Cc1ccc(cc1....
26 2EWA - SB2 C21 H16 F N3 O S C[S@](=O)c....
27 2GHL - LIB C23 H26 Cl N5 O3 C[C@@H](C(....
28 1ZZ2 ic50 = 6 uM B11 C24 H26 F N3 O4 S c1ccc(c(c1....
29 3ZSI - 52P C19 H9 Cl2 F2 N3 O S c1cc(c(c(c....
30 2YIW - YIW C30 H33 N7 O S CC(C)c1nnc....
31 5WJJ ic50 = 5.4 nM AQY C25 H19 F N6 O2 Cc1cc(ccc1....
32 1A9U - SB2 C21 H16 F N3 O S C[S@](=O)c....
33 1M7Q ic50 = 2.6 nM DQO C24 H20 Cl2 F2 N4 O c1cc(c(c(c....
34 5MTY Kd = 1.3 nM HB9 C29 H23 F2 N3 O4 S c1cc(sc1)C....
35 4EH7 - IRG C17 H16 N4 c1ccc(cc1)....
36 1YQJ ic50 = 7.3 nM 6NP C30 H27 N5 c1ccc(cc1)....
37 4EH3 - NAR C15 H12 O5 c1cc(ccc1[....
38 4AA5 ic50 = 6.7 nM NQB C24 H27 N5 O2 Cc1ccc(cc1....
39 1OVE ic50 = 0.74 nM 358 C26 H22 Cl2 F2 N2 O c1cc(c(c(c....
40 3UVP ic50 = 0.035 uM 048 C24 H21 F N2 O2 c1ccc(cc1)....
41 5N67 - 8ON C28 H30 N6 O CC(=O)N1CC....
42 3NNV ic50 = 27 nM 437 C25 H26 N4 O2 CC(C)(C)c1....
43 3CTQ ic50 = 40 nM 337 C30 H34 N6 O5 S Cc1ccc(cc1....
44 3IW7 - IPK C26 H26 N4 O S c1ccc(cc1)....
45 3ITZ ic50 = 1.4 nM P66 C21 H15 Cl F2 N6 O c1cc(c(c(c....
46 2ZB1 Ki = 0.48 uM GK4 C21 H21 N3 O2 Cc1ccc(cc1....
47 3HV5 ic50 = 150 nM R24 C30 H29 N7 O3 Cc1ccc(cc1....
48 1WBW ic50 = 44 uM LI4 C16 H14 N2 O c1ccc2c(c1....
49 3P79 ic50 = 2.3 uM P79 C24 H29 N5 O4 S CC(C)(C)c1....
50 3HV7 ic50 = 90 nM 1AU C24 H25 N5 O CC(C)(C)c1....
51 3GFE ic50 = 3.2 nM P37 C24 H21 F2 N5 O2 Cc1ccc(cc1....
52 3ZYA - 2A8 C21 H18 N2 O c1ccc2c(c1....
53 2RG5 ic50 = 3.1 nM 279 C19 H22 N6 O3 CCNC(=O)c1....
54 3L8X ic50 = 10 nM N4D C20 H18 N6 O Cc1ccc(cc1....
55 3GCS Kd = 56 nM BAX C21 H16 Cl F3 N4 O3 CNC(=O)c1c....
56 3ZS5 - SB2 C21 H16 F N3 O S C[S@](=O)c....
57 3D83 Ki = 4.4 nM GK6 C28 H30 N4 O3 Cc1ccc(cc1....
58 1YW2 ic50 = 141 nM PGJ C22 H18 F N3 O5 CCOC[N@]1C....
59 1W82 ic50 = 196 nM L10 C20 H21 Cl N4 O CC(C)(C)C1....
60 3ZSG - T75 C24 H21 N3 O S CCc1nc(c(s....
61 5TCO Kd = 3.14 nM 79Q C35 H33 F N4 O4 c1ccc(cc1)....
62 4EH8 - IRG C17 H16 N4 c1ccc(cc1)....
63 3GCP Kd = 15 nM SB2 C21 H16 F N3 O S C[S@](=O)c....
64 3HLL Ki = 0.0058 uM I45 C22 H19 Br F2 N2 O3 Cc1ccc(cc1....
65 1ZZL ic50 = 5 nM TZY C18 H15 F N4 O CC(C)c1nnc....
66 2RG6 ic50 = 2.2 nM 287 C25 H26 N6 O3 Cc1ccc(cc1....
67 3MPT ic50 = 0.25 uM 1GK C18 H16 N2 O3 Cc1ccccc1C....
68 1BL6 - SB6 C18 H16 F N3 c1cc(ccc1c....
69 3NNW ic50 = 9 nM EDD C22 H23 Cl2 N5 O2 CC(C)(C)C1....
70 3GI3 Kd < 1.8 nM B10 C33 H39 N5 O5 S CC(C)(C)c1....
71 3K3J - I46 C14 H9 F2 N3 c1cc(ccc1c....
72 3HEC ic50 = 70 uM STI C29 H31 N7 O Cc1ccc(cc1....
73 1IAN - D13 C21 H16 I N3 O S C[S@@](=O)....
74 3FC1 - 52P C19 H9 Cl2 F2 N3 O S c1cc(c(c(c....
75 3MVM ic50 = 13 nM 39P C22 H23 N7 O3 CCCNC(=O)c....
76 3NNU ic50 = 48 nM EDB C22 H17 Cl2 N5 O2 S c1cc(cc(c1....
77 1W7H ic50 = 1 mM 3IP C12 H12 N2 O c1ccc(cc1)....
78 3U8W ic50 = 1 nM 09J C24 H21 Cl F N5 O2 CCN1C(=O)C....
79 1WBS ic50 = 0.63 uM LI2 C26 H25 F N4 O2 c1cc2c(cc1....
80 4E6C Kd ~ 15 uM 0O8 C25 H53 N O4 P CCCCCCCCCC....
81 5N68 - 8OK C26 H27 N5 O c1ccc(cc1)....
82 1WBV ic50 = 162 uM LI3 C19 H18 F N3 O2 c1cc2c(cc[....
83 4EH2 - IRG C17 H16 N4 c1ccc(cc1)....
84 3HA8 - 5JZ C36 H38 N8 O5 CCOc1nc(nc....
85 3HEG ic50 = 0.057 uM BAX C21 H16 Cl F3 N4 O3 CNC(=O)c1c....
86 2ZAZ Ki = 0.4 uM GK1 C20 H15 N3 O2 S Cc1ccc(cc1....
87 3HP5 - I46 C14 H9 F2 N3 c1cc(ccc1c....
88 5ML5 ic50 = 10 nM 1VI C26 H25 F N4 O3 S COc1ccc(c(....
89 4DLI Kd = 2.4 uM IRG C17 H16 N4 c1ccc(cc1)....
90 3P78 ic50 = 0.11 uM P78 C24 H27 N3 O4 S2 CC(C)(C)c1....
91 4EH9 - IRG C17 H16 N4 c1ccc(cc1)....
92 1YWR ic50 = 32 nM LI9 C27 H29 F N6 O C[C@@H](c1....
93 3IW5 Kd = 0.839 uM DF3 C28 H24 F3 N3 O4 S c1ccc2c(c1....
94 3HV3 ic50 = 900 nM R49 C30 H31 N7 O Cc1cccc(c1....
95 4A9Y - RNY C32 H37 N7 O4 Cc1ccc(cc1....
96 3GCU - R48 C29 H30 N8 O Cc1ccc(cc1....
97 1OUY ic50 = 4.3 nM 094 C24 H18 Cl2 F2 N4 O S c1cc(c(c(c....
98 3D7Z Ki = 12 nM GK5 C22 H24 N2 O2 Cc1ccc(cc1....
99 2YIS - YIS C35 H34 Cl N7 O3 S2 CC(C)(C)c1....
100 1OUK ic50 = 0.13 nM 084 C28 H29 F3 N6 C[C@@H](c1....
101 3BV2 Ki = 0.44 nM P38 C33 H32 N8 O3 Cc1ccc(cc1....
102 4R3C - GG5 C14 H10 F N3 c1cc(ccc1c....
103 4L8M ic50 = 0.001 uM F46 C33 H30 F N3 O5 c1ccc(cc1)....
104 4E6A - 0O9 C32 H65 O10 P CCCCCCCCCC....
105 1WBN ic50 = 0.35 uM L09 C20 H22 Cl N5 O2 CC(C)(C)c1....
106 2QD9 ic50 = 13 nM LGF C27 H24 F2 N6 O5 COc1c(cc2c....
107 3HUC Kd = 1030 nM G97 C20 H16 N6 O C=CC(=O)Nc....
108 3HL7 Ki = 0.023 uM I47 C20 H20 Cl N5 O2 c1cc(ccc1c....
109 4EHV - IRG C17 H16 N4 c1ccc(cc1)....
110 2GTN ic50 = 4 nM LIE C20 H16 F3 N5 O CC(C)n1c2c....
111 3HRB ic50 = 21 nM I39 C19 H14 F2 N2 O2 Cc1ccccc1c....
112 3BX5 ic50 = 1.5 nM 304 C17 H22 N4 O2 S CC[C@@H](C....
113 3HVC ic50 = 600 nM GG5 C14 H10 F N3 c1cc(ccc1c....
114 2GFS ic50 = 0.7 uM PQB C19 H18 F N3 O4 c1cc(cc(c1....
115 5N63 - 8OW C21 H17 F N4 c1ccc(cc1)....
116 2NPQ Kd = 3.08 uM BOG C14 H28 O6 CCCCCCCCO[....
117 3IW6 Kd = 3.29 uM PP0 C23 H31 N3 O3 CCn1c(c(c(....
118 3S4Q ic50 = 4 nM NK0 C25 H23 N5 O2 Cc1ccc(cc1....
119 2BAJ Kd = 4 nM 1PP C20 H20 Cl2 N4 O CC(C)(C)c1....
120 3ROC - 29B C14 H10 F N3 c1cc(ccc1c....
121 3NWW ic50 = 7 nM 3NW C24 H34 N8 O S CCNC(=O)NC....
122 1W83 ic50 = 0.065 uM L11 C23 H25 Cl F N3 O3 c1cc(cnc1)....
123 3ZSH - 469 C27 H30 Cl F N4 O3 C[C@@H]1C[....
124 3IPH Ki = 0.0000251 mM G11 C21 H23 N3 O2 Cc1ccc(cc1....
125 5MZ3 ic50 = 0.00021 uM 8EN C24 H19 F3 N4 O2 Cc1ccc(cc1....
126 3P7B ic50 = 0.018 uM P7B C25 H28 N4 O3 S CC(C)(C)c1....
127 3GCQ Kd = 342 nM 1BU C29 H30 N8 O Cc1cccc(c1....
128 4F9Y Ki = 184 nM LM3 C21 H18 N4 CN(C)c1cc(....
129 2BAL Kd = 490 nM PQA C21 H21 F N4 O2 c1cc(cc(c1....
130 3HUB Kd = 8.2 nM 469 C27 H30 Cl F N4 O3 C[C@@H]1C[....
131 4F9W Ki = 114 nM LM4 C21 H18 N4 CN(C)c1cc(....
132 3P5K ic50 = 0.076 uM P5K C24 H27 N3 O4 S2 CC(C)(C)c1....
133 2I0H ic50 = 9 nM 222 C27 H19 Cl2 F N4 O3 c1ccc2c(c1....
134 1ZYJ ic50 = 1.5 uM BI5 C19 H16 N2 O2 c1ccc(cc1)....
135 3K3I - JZJ C18 H16 Br N3 c1ccc2c(c1....
136 1WBT ic50 = 0.34 uM WBT C26 H25 F N4 O2 c1cc(cc2c1....
137 1BMK - SB5 C17 H16 F N5 c1cc(ccc1c....
138 3E92 Ki = 10 nM G6A C21 H21 N3 O2 Cc1ccc(cc1....
139 3P7A ic50 = 0.52 uM P7A C23 H27 N3 O3 S2 CC(C)(C)c1....
140 6ANL ic50 = 240 nM T75 C24 H21 N3 O S CCc1nc(c(s....
141 3NNX ic50 = 11 nM EDD C22 H23 Cl2 N5 O2 CC(C)(C)C1....
142 4EH4 - IRG C17 H16 N4 c1ccc(cc1)....
143 1KV1 Kd = 1.16 uM BMU C15 H19 Cl N4 O CC(C)(C)c1....
144 3KF7 ic50 = 40 nM L9G C22 H18 F2 N4 O Cc1ccc(cc1....
145 4KIN ic50 = 4.8 nM 1M8 C22 H19 Cl N2 O2 S Cc1ccc(cc1....
146 4AA4 ic50 = 9 nM QC0 C25 H25 N5 O3 Cc1ccc(cc1....
147 5XYY ic50 = 9.221 uM P0F C15 H12 Cl F N4 O c1cc(cc(c1....
148 3E93 Ki = 1.4 nM 19B C30 H32 N4 O3 Cc1ccc(cc1....
149 4AAC ic50 = 16 nM AAV C24 H24 N6 O3 Cc1ccc(cc1....
150 4AA0 ic50 = 35 nM AA0 C30 H33 N7 O3 Cc1ccc(cc1....
151 1OZ1 ic50 = 6.5 nM FPH C18 H12 F N3 O c1cc2c(c(c....
152 5N64 - 8OH C19 H16 N4 S c1ccc(cc1)....
153 3IW8 Kd = 13.4 uM HIZ C19 H18 Cl F N4 O2 S c1ccc(cc1)....
70% Homology Family (159)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 10 families.
1 3GCV Kd = 74 nM SS6 C29 H30 N8 O Cc1cccc(c1....
2 3L8S Kd = 99 nM BFF C20 H24 Br F2 N5 O3 S c1c(cc(c(c....
3 3RIN ic50 = 1.3 nM I2O C23 H24 N2 O2 Cc1ccc(cc1....
4 5N65 - 8OT C20 H18 N4 S c1ccc(cc1)....
5 4FA2 - SB0 C20 H21 F N4 O2 COc1nccc(n....
6 2GHM - LIC C24 H28 Cl N5 O3 C[C@@H](C(....
7 1W84 ic50 = 35 uM L12 C15 H14 N2 c1ccc2c(c1....
8 4EH5 - IRG C17 H16 N4 c1ccc(cc1)....
9 2BAK Kd = 37 nM AQZ C32 H37 N7 O4 Cc1ccc(cc1....
10 3HV6 ic50 = 5500 nM R39 C27 H35 N5 O3 Cc1ccc(cc1....
11 3HP2 - P36 C19 H16 Br N O2 c1ccc(cc1)....
12 1WBO ic50 = 1 mM 2CH C6 H5 Cl O c1ccc(c(c1....
13 4KIQ ic50 = 23 nM 1RA C23 H23 N3 O4 CCOC(=O)n1....
14 3GC7 ic50 = 0.4 nM B45 C28 H27 Cl3 F N3 O CC(C)N1CCC....
15 4EH6 - IRG C17 H16 N4 c1ccc(cc1)....
16 5MTX Kd = 17.7 nM FJI C34 H31 F N4 O5 c1ccc(cc1)....
17 2ZB0 Ki = 0.24 uM GK3 C24 H18 N4 O2 Cc1ccc(cc1....
18 2GTM ic50 = 542 nM LID C19 H15 Cl F2 N6 CCn1c2c(cn....
19 5N66 - B96 C31 H37 N5 O3 Cc1ccc(cc1....
20 2YIX Kd = 3.3 nM YIX C19 H23 N5 O S CCNC(=O)NC....
21 3OCG ic50 = 3 nM OCG C21 H18 N6 O3 Cc1ccc(cc1....
22 1BL7 - SB4 C18 H19 F N6 c1cc(ccc1c....
23 3P7C ic50 = 0.022 uM P7C C25 H33 Cl2 N5 O3 S CC(C)(C)c1....
24 5TBE Kd = 4.4 nM 78L C33 H30 F2 N4 O4 S c1cc(sc1)C....
25 4KIP ic50 = 7 nM 1R9 C21 H18 Cl N3 O2 S Cc1ccc(cc1....
26 2EWA - SB2 C21 H16 F N3 O S C[S@](=O)c....
27 2GHL - LIB C23 H26 Cl N5 O3 C[C@@H](C(....
28 1ZZ2 ic50 = 6 uM B11 C24 H26 F N3 O4 S c1ccc(c(c1....
29 3ZSI - 52P C19 H9 Cl2 F2 N3 O S c1cc(c(c(c....
30 2YIW - YIW C30 H33 N7 O S CC(C)c1nnc....
31 5WJJ ic50 = 5.4 nM AQY C25 H19 F N6 O2 Cc1cc(ccc1....
32 1A9U - SB2 C21 H16 F N3 O S C[S@](=O)c....
33 1M7Q ic50 = 2.6 nM DQO C24 H20 Cl2 F2 N4 O c1cc(c(c(c....
34 5MTY Kd = 1.3 nM HB9 C29 H23 F2 N3 O4 S c1cc(sc1)C....
35 4EH7 - IRG C17 H16 N4 c1ccc(cc1)....
36 1YQJ ic50 = 7.3 nM 6NP C30 H27 N5 c1ccc(cc1)....
37 4EH3 - NAR C15 H12 O5 c1cc(ccc1[....
38 4AA5 ic50 = 6.7 nM NQB C24 H27 N5 O2 Cc1ccc(cc1....
39 1OVE ic50 = 0.74 nM 358 C26 H22 Cl2 F2 N2 O c1cc(c(c(c....
40 3UVP ic50 = 0.035 uM 048 C24 H21 F N2 O2 c1ccc(cc1)....
41 5N67 - 8ON C28 H30 N6 O CC(=O)N1CC....
42 3NNV ic50 = 27 nM 437 C25 H26 N4 O2 CC(C)(C)c1....
43 3CTQ ic50 = 40 nM 337 C30 H34 N6 O5 S Cc1ccc(cc1....
44 3IW7 - IPK C26 H26 N4 O S c1ccc(cc1)....
45 3ITZ ic50 = 1.4 nM P66 C21 H15 Cl F2 N6 O c1cc(c(c(c....
46 2ZB1 Ki = 0.48 uM GK4 C21 H21 N3 O2 Cc1ccc(cc1....
47 3HV5 ic50 = 150 nM R24 C30 H29 N7 O3 Cc1ccc(cc1....
48 1WBW ic50 = 44 uM LI4 C16 H14 N2 O c1ccc2c(c1....
49 3P79 ic50 = 2.3 uM P79 C24 H29 N5 O4 S CC(C)(C)c1....
50 3HV7 ic50 = 90 nM 1AU C24 H25 N5 O CC(C)(C)c1....
51 3GFE ic50 = 3.2 nM P37 C24 H21 F2 N5 O2 Cc1ccc(cc1....
52 3ZYA - 2A8 C21 H18 N2 O c1ccc2c(c1....
53 2RG5 ic50 = 3.1 nM 279 C19 H22 N6 O3 CCNC(=O)c1....
54 3L8X ic50 = 10 nM N4D C20 H18 N6 O Cc1ccc(cc1....
55 3GCS Kd = 56 nM BAX C21 H16 Cl F3 N4 O3 CNC(=O)c1c....
56 3ZS5 - SB2 C21 H16 F N3 O S C[S@](=O)c....
57 3D83 Ki = 4.4 nM GK6 C28 H30 N4 O3 Cc1ccc(cc1....
58 1YW2 ic50 = 141 nM PGJ C22 H18 F N3 O5 CCOC[N@]1C....
59 1W82 ic50 = 196 nM L10 C20 H21 Cl N4 O CC(C)(C)C1....
60 3ZSG - T75 C24 H21 N3 O S CCc1nc(c(s....
61 5TCO Kd = 3.14 nM 79Q C35 H33 F N4 O4 c1ccc(cc1)....
62 4EH8 - IRG C17 H16 N4 c1ccc(cc1)....
63 3GCP Kd = 15 nM SB2 C21 H16 F N3 O S C[S@](=O)c....
64 3HLL Ki = 0.0058 uM I45 C22 H19 Br F2 N2 O3 Cc1ccc(cc1....
65 1ZZL ic50 = 5 nM TZY C18 H15 F N4 O CC(C)c1nnc....
66 2RG6 ic50 = 2.2 nM 287 C25 H26 N6 O3 Cc1ccc(cc1....
67 3MPT ic50 = 0.25 uM 1GK C18 H16 N2 O3 Cc1ccccc1C....
68 1BL6 - SB6 C18 H16 F N3 c1cc(ccc1c....
69 3NNW ic50 = 9 nM EDD C22 H23 Cl2 N5 O2 CC(C)(C)C1....
70 3GI3 Kd < 1.8 nM B10 C33 H39 N5 O5 S CC(C)(C)c1....
71 3K3J - I46 C14 H9 F2 N3 c1cc(ccc1c....
72 3HEC ic50 = 70 uM STI C29 H31 N7 O Cc1ccc(cc1....
73 1IAN - D13 C21 H16 I N3 O S C[S@@](=O)....
74 3FC1 - 52P C19 H9 Cl2 F2 N3 O S c1cc(c(c(c....
75 3MVM ic50 = 13 nM 39P C22 H23 N7 O3 CCCNC(=O)c....
76 3NNU ic50 = 48 nM EDB C22 H17 Cl2 N5 O2 S c1cc(cc(c1....
77 1W7H ic50 = 1 mM 3IP C12 H12 N2 O c1ccc(cc1)....
78 3U8W ic50 = 1 nM 09J C24 H21 Cl F N5 O2 CCN1C(=O)C....
79 1WBS ic50 = 0.63 uM LI2 C26 H25 F N4 O2 c1cc2c(cc1....
80 4E6C Kd ~ 15 uM 0O8 C25 H53 N O4 P CCCCCCCCCC....
81 5N68 - 8OK C26 H27 N5 O c1ccc(cc1)....
82 1WBV ic50 = 162 uM LI3 C19 H18 F N3 O2 c1cc2c(cc[....
83 4EH2 - IRG C17 H16 N4 c1ccc(cc1)....
84 3HA8 - 5JZ C36 H38 N8 O5 CCOc1nc(nc....
85 3HEG ic50 = 0.057 uM BAX C21 H16 Cl F3 N4 O3 CNC(=O)c1c....
86 2ZAZ Ki = 0.4 uM GK1 C20 H15 N3 O2 S Cc1ccc(cc1....
87 3HP5 - I46 C14 H9 F2 N3 c1cc(ccc1c....
88 5ML5 ic50 = 10 nM 1VI C26 H25 F N4 O3 S COc1ccc(c(....
89 4DLI Kd = 2.4 uM IRG C17 H16 N4 c1ccc(cc1)....
90 3P78 ic50 = 0.11 uM P78 C24 H27 N3 O4 S2 CC(C)(C)c1....
91 4EH9 - IRG C17 H16 N4 c1ccc(cc1)....
92 1YWR ic50 = 32 nM LI9 C27 H29 F N6 O C[C@@H](c1....
93 3IW5 Kd = 0.839 uM DF3 C28 H24 F3 N3 O4 S c1ccc2c(c1....
94 3HV3 ic50 = 900 nM R49 C30 H31 N7 O Cc1cccc(c1....
95 4A9Y - RNY C32 H37 N7 O4 Cc1ccc(cc1....
96 3GCU - R48 C29 H30 N8 O Cc1ccc(cc1....
97 1OUY ic50 = 4.3 nM 094 C24 H18 Cl2 F2 N4 O S c1cc(c(c(c....
98 3D7Z Ki = 12 nM GK5 C22 H24 N2 O2 Cc1ccc(cc1....
99 2YIS - YIS C35 H34 Cl N7 O3 S2 CC(C)(C)c1....
100 1OUK ic50 = 0.13 nM 084 C28 H29 F3 N6 C[C@@H](c1....
101 3BV2 Ki = 0.44 nM P38 C33 H32 N8 O3 Cc1ccc(cc1....
102 4R3C - GG5 C14 H10 F N3 c1cc(ccc1c....
103 4L8M ic50 = 0.001 uM F46 C33 H30 F N3 O5 c1ccc(cc1)....
104 4E6A - 0O9 C32 H65 O10 P CCCCCCCCCC....
105 1WBN ic50 = 0.35 uM L09 C20 H22 Cl N5 O2 CC(C)(C)c1....
106 2QD9 ic50 = 13 nM LGF C27 H24 F2 N6 O5 COc1c(cc2c....
107 3HUC Kd = 1030 nM G97 C20 H16 N6 O C=CC(=O)Nc....
108 3HL7 Ki = 0.023 uM I47 C20 H20 Cl N5 O2 c1cc(ccc1c....
109 4EHV - IRG C17 H16 N4 c1ccc(cc1)....
110 2GTN ic50 = 4 nM LIE C20 H16 F3 N5 O CC(C)n1c2c....
111 3HRB ic50 = 21 nM I39 C19 H14 F2 N2 O2 Cc1ccccc1c....
112 3BX5 ic50 = 1.5 nM 304 C17 H22 N4 O2 S CC[C@@H](C....
113 3HVC ic50 = 600 nM GG5 C14 H10 F N3 c1cc(ccc1c....
114 2GFS ic50 = 0.7 uM PQB C19 H18 F N3 O4 c1cc(cc(c1....
115 5N63 - 8OW C21 H17 F N4 c1ccc(cc1)....
116 2NPQ Kd = 3.08 uM BOG C14 H28 O6 CCCCCCCCO[....
117 3IW6 Kd = 3.29 uM PP0 C23 H31 N3 O3 CCn1c(c(c(....
118 3S4Q ic50 = 4 nM NK0 C25 H23 N5 O2 Cc1ccc(cc1....
119 2BAJ Kd = 4 nM 1PP C20 H20 Cl2 N4 O CC(C)(C)c1....
120 3ROC - 29B C14 H10 F N3 c1cc(ccc1c....
121 3NWW ic50 = 7 nM 3NW C24 H34 N8 O S CCNC(=O)NC....
122 1W83 ic50 = 0.065 uM L11 C23 H25 Cl F N3 O3 c1cc(cnc1)....
123 3ZSH - 469 C27 H30 Cl F N4 O3 C[C@@H]1C[....
124 3IPH Ki = 0.0000251 mM G11 C21 H23 N3 O2 Cc1ccc(cc1....
125 5MZ3 ic50 = 0.00021 uM 8EN C24 H19 F3 N4 O2 Cc1ccc(cc1....
126 3P7B ic50 = 0.018 uM P7B C25 H28 N4 O3 S CC(C)(C)c1....
127 3GCQ Kd = 342 nM 1BU C29 H30 N8 O Cc1cccc(c1....
128 4F9Y Ki = 184 nM LM3 C21 H18 N4 CN(C)c1cc(....
129 2BAL Kd = 490 nM PQA C21 H21 F N4 O2 c1cc(cc(c1....
130 3HUB Kd = 8.2 nM 469 C27 H30 Cl F N4 O3 C[C@@H]1C[....
131 4F9W Ki = 114 nM LM4 C21 H18 N4 CN(C)c1cc(....
132 3P5K ic50 = 0.076 uM P5K C24 H27 N3 O4 S2 CC(C)(C)c1....
133 2I0H ic50 = 9 nM 222 C27 H19 Cl2 F N4 O3 c1ccc2c(c1....
134 1ZYJ ic50 = 1.5 uM BI5 C19 H16 N2 O2 c1ccc(cc1)....
135 3K3I - JZJ C18 H16 Br N3 c1ccc2c(c1....
136 1WBT ic50 = 0.34 uM WBT C26 H25 F N4 O2 c1cc(cc2c1....
137 1BMK - SB5 C17 H16 F N5 c1cc(ccc1c....
138 3E92 Ki = 10 nM G6A C21 H21 N3 O2 Cc1ccc(cc1....
139 3P7A ic50 = 0.52 uM P7A C23 H27 N3 O3 S2 CC(C)(C)c1....
140 6ANL ic50 = 240 nM T75 C24 H21 N3 O S CCc1nc(c(s....
141 3NNX ic50 = 11 nM EDD C22 H23 Cl2 N5 O2 CC(C)(C)C1....
142 4EH4 - IRG C17 H16 N4 c1ccc(cc1)....
143 1KV1 Kd = 1.16 uM BMU C15 H19 Cl N4 O CC(C)(C)c1....
144 3KF7 ic50 = 40 nM L9G C22 H18 F2 N4 O Cc1ccc(cc1....
145 4KIN ic50 = 4.8 nM 1M8 C22 H19 Cl N2 O2 S Cc1ccc(cc1....
146 4AA4 ic50 = 9 nM QC0 C25 H25 N5 O3 Cc1ccc(cc1....
147 5XYY ic50 = 9.221 uM P0F C15 H12 Cl F N4 O c1cc(cc(c1....
148 3E93 Ki = 1.4 nM 19B C30 H32 N4 O3 Cc1ccc(cc1....
149 4AAC ic50 = 16 nM AAV C24 H24 N6 O3 Cc1ccc(cc1....
150 4AA0 ic50 = 35 nM AA0 C30 H33 N7 O3 Cc1ccc(cc1....
151 1OZ1 ic50 = 6.5 nM FPH C18 H12 F N3 O c1cc2c(c(c....
152 5N64 - 8OH C19 H16 N4 S c1ccc(cc1)....
153 3IW8 Kd = 13.4 uM HIZ C19 H18 Cl F N4 O2 S c1ccc(cc1)....
154 3GC8 - B45 C28 H27 Cl3 F N3 O CC(C)N1CCC....
155 3GC9 - B45 C28 H27 Cl3 F N3 O CC(C)N1CCC....
156 4EYM - 0RX C21 H20 N4 O3 c1cc(ccc1N....
157 5EKO ic50 = 15785 nM N17 C22 H18 N4 O2 Cc1cn(cn1)....
158 4EYJ - N61 C20 H23 N5 O2 CC(C)(C)c1....
159 1CM8 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 6GDM - F3Z C33 H33 N9 O2 c1cnc(nc1)....
2 4XP3 - DX4 C5 H5 N5 S c1[nH]c2c(....
3 3GCV Kd = 74 nM SS6 C29 H30 N8 O Cc1cccc(c1....
4 3L8S Kd = 99 nM BFF C20 H24 Br F2 N5 O3 S c1c(cc(c(c....
5 3RIN ic50 = 1.3 nM I2O C23 H24 N2 O2 Cc1ccc(cc1....
6 5N65 - 8OT C20 H18 N4 S c1ccc(cc1)....
7 4H3B Kd = 17.2 uM VAL VAL ARG PRO GLY SER LEU ASP LEU PRO n/a n/a
8 4ZSL - 4QZ C17 H17 Cl N6 O C[C@@H](c1....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: I2O; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 I2O 1 1
2 GK5 0.433333 0.66
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1OUK; Ligand: 084; Similar sites found with APoc: 553
This union binding pocket(no: 1) in the query (biounit: 1ouk.bio1) has 90 residues
No: Leader PDB Ligand Sequence Similarity
1 4WG0 CHD None
2 1UO5 PIH None
3 6E2B PT7 None
4 5ZCT ANP 1.30719
5 1YKD CMP 1.36612
6 6ENO BJ8 1.36612
7 5GLT BGC GAL NAG GAL 1.40845
8 3AQT RCO 1.63265
9 4GYI ADP 1.63934
10 1ZED PNP 1.63934
11 1ON3 DXX 1.63934
12 3OV6 MK0 1.63934
13 4I90 CHT 1.65016
14 5IGI GMP 1.66113
15 1KDK DHT 1.69492
16 5UGW GSH 1.71429
17 2MSB NAG BMA MAN MAN MAN MAN MAN 1.73913
18 1J49 NAD 1.8018
19 3PDT ADP 1.81818
20 1GSA ADP 1.89873
21 1VRP ADP 1.91257
22 5FPE 3TR 1.91257
23 3WVR AMP 1.91257
24 3ORQ ADP 1.91257
25 3AKI AH8 1.91257
26 1WS1 BB2 1.92308
27 5DKK FMN 2.06897
28 4XMF HSM 2.17391
29 4ARU TLA 2.18579
30 3DNT ATP 2.18579
31 5KR7 6X9 2.18579
32 5IM3 DTP 2.18579
33 3G5K BB2 2.18579
34 4F97 GDP 2.18579
35 4KVL PLM 2.18579
36 5VM6 9EG 2.18978
37 2GTF P1R 2.22222
38 4YBN FAD 2.23214
39 4OUC 5ID 2.2409
40 6G34 5ID 2.2409
41 2FUE M1P 2.29008
42 2I6A 5I5 2.31884
43 2GWH PCI 2.34899
44 2ZL7 FUC GAL NGA 2.37288
45 2RDE C2E 2.39044
46 3ZJX BOG 2.42215
47 4IPH 1FJ 2.43902
48 4RD0 GDP 2.45902
49 3R9C ECL 2.45902
50 3A06 FOM 2.45902
51 2ORO 228 2.45902
52 3T1A 5MA 2.45902
53 3DLG GWE 2.45902
54 4ZGS NAD 2.45902
55 1IA9 ANP 2.5
56 2OG2 MLI 2.50696
57 5M42 FMN 2.50896
58 5KY9 GDP 2.53521
59 4C5N ACP 2.53623
60 2Z3U CRR 2.58824
61 4RDL FUC GAL NDG FUC 2.5974
62 5IJJ I6P 2.60417
63 5M36 9SZ 2.62009
64 1CX4 CMP 2.62295
65 3KYG 5GP 5GP 2.64317
66 6H8S FSZ 2.65781
67 5FLJ QUE 2.68817
68 2G30 ALA ALA PHE 2.71318
69 5I35 ANP 2.73224
70 5OES ADP 2.73224
71 2VQD AP2 2.73224
72 3K5I ADP 2.73224
73 3A16 PXO 2.73224
74 2V58 LZJ 2.73224
75 6GBV FMN 2.73973
76 5DYO FLU 2.75229
77 1Q6O LG6 2.77778
78 4O4F ATP 2.82258
79 4O4F IHP 2.82258
80 2XG5 EC5 2.89017
81 2XG5 EC2 2.89017
82 1I7L ATP 2.91262
83 2HJ4 PNZ 2.96296
84 2DC1 NAD 2.9661
85 3B9Q MLI 2.98013
86 5YJS SAL 3.00546
87 2VAT COA 3.00546
88 5J75 6GQ 3.0303
89 3THR C2F 3.07167
90 3SAO DBH 3.125
91 2Q8E OGA 3.125
92 5OCG 9R5 3.1746
93 3RGA LSB 3.18021
94 5GG9 8GM 3.21637
95 4O4Z N2O 3.24675
96 4ZS4 ATP 3.25733
97 3E7S AT2 3.27869
98 4CU1 71S 3.27869
99 1R6N 434 3.31754
100 3ETH ATP 3.38028
101 5UC9 MYR 3.53982
102 2PUL ACP 3.55191
103 5MW8 ATP 3.55191
104 1EHI ADP 3.55191
105 4MOB ADP 3.61446
106 3EXS 5RP 3.61991
107 3OF1 CMP 3.65854
108 3EUF BAU 3.65854
109 2Z9I GLY ALA THR VAL 3.7037
110 3ACL 3F1 3.71622
111 5NM7 GLY 3.7594
112 5F6U 5VK 3.82166
113 5YK1 ANP 3.82514
114 4WOE ADP 3.82514
115 4CJN QNZ 3.82514
116 4DXD 9PC 3.82514
117 4V3I ASP LEU THR ARG PRO 3.89105
118 5LX9 OLB 3.90879
119 5GZ9 ANP 3.93443
120 1TZD ADP 4
121 4DFU QUE 4.03727
122 5C4L SIS 4.04984
123 3UDZ ADP 4.09836
124 5HV7 RBL 4.09836
125 2YW2 ATP 4.09836
126 4PU5 ANP 4.09836
127 2YBQ SAH 4.10959
128 1W2D ADP 4.15094
129 1W2D 4IP 4.15094
130 5DCH 1YO 4.16667
131 5OGX FAD 4.16667
132 1GQG DCD 4.28571
133 4R38 RBF 4.28571
134 3TAY MN0 4.29448
135 3OCP CMP 4.31655
136 4XYM A12 4.34783
137 6FL8 TIY 4.37158
138 6FL8 ADP 4.37158
139 4PAB THG 4.37158
140 4RT1 C2E 4.46429
141 1FWV SGA MAG FUC 4.47761
142 2PR5 FMN 4.54545
143 5HWV MBN 4.61538
144 1QD1 FON 4.61538
145 5FI4 5XV 4.64481
146 1I1E DM2 4.64481
147 3TPV ADE 4.64481
148 5DMZ ADP 4.65753
149 4RHP PEF 4.68085
150 2W5P CL8 4.69799
151 3KYF 5GP 5GP 4.7619
152 3SE5 ANP 4.87805
153 1PK8 ATP 4.91803
154 1LSH PLD 4.91803
155 2VWA PTY 4.9505
156 1M2Z BOG 5.05837
157 2GQS C2R 5.06329
158 6BR8 PGV 5.15873
159 3T4L ZEA 5.18518
160 1MJT ITU 5.18732
161 5USZ SKE 5.19031
162 3Q60 ATP 5.19126
163 3JU6 ANP 5.19126
164 5MRH Q9Z 5.19126
165 3MF2 AMP 5.20231
166 4DR9 BB2 5.20833
167 1OBD ATP 5.22876
168 2XZ9 PYR 5.24691
169 1L6O SER LEU LYS LEU MET THR THR VAL 5.26316
170 6CS8 F9Y 5.28053
171 4Q9M 2ZW 5.28455
172 4X9X OLA 5.35117
173 1SDW IYT 5.41401
174 1ZTH ADP 5.42636
175 1ZP9 ATP 5.42636
176 3RE4 TO1 5.42636
177 4U8P UDP 5.46448
178 2PYW ADP 5.46448
179 5TDF ADP 5.46448
180 5UL4 SAM 5.46448
181 4NOS ITU 5.46448
182 6CC0 EWM 5.48523
183 1KGI T4A 5.51181
184 5OCA 9QZ 5.55556
185 1BC5 ACE ASN TRP GLU THR PHE 5.57621
186 1F52 ADP 5.7377
187 1ELI PYC 5.7377
188 6FA4 D1W 5.78035
189 1AUX AGS 5.78778
190 3N1S 5GP 5.88235
191 2X6T NAP 5.88235
192 1UUY PPI 5.98802
193 4YVN EBS 6.01093
194 2O1V ADP 6.01093
195 1A5Z FBP 6.01093
196 4UWH JXM 6.01093
197 1XMY ROL 6.01093
198 1F9V ADP 6.05187
199 1WMA AB3 6.15942
200 3NOJ PYR 6.30252
201 3X01 AMP 6.36132
202 5EJL C2E 6.45161
203 2YKL NLD 6.48148
204 3O01 DXC 6.49351
205 3TDV GDP 6.53595
206 4O1P ANP 6.55738
207 4OCV ANP 6.55738
208 3B6R ADP 6.55738
209 1U6R ADP 6.55738
210 3CBC DBS 6.56566
211 6ACS CIT 6.58915
212 3VPC ADP 6.73759
213 3VPB ADP 6.73759
214 5V4R MGT 6.79012
215 4OAV ACP 6.8306
216 5G48 1FL 6.8306
217 4IAW LIZ 6.91489
218 4MVK ACE VAL PHE PHE ALA GLU ASP NH2 6.91489
219 5H9P TD2 6.96203
220 5KJW 53C 7.10383
221 4K55 H6P 7.25806
222 5H9Y BGC BGC BGC BGC 7.37705
223 3UXL CFI 7.37705
224 1NE6 SP1 7.42049
225 5DQ8 FLF 7.5
226 6CGD AKN 7.54098
227 6CGD GNP 7.54098
228 4BG4 ADP 7.58427
229 4RF7 ARG 7.65027
230 3I0O ADP 7.66962
231 4Y24 TD2 7.79221
232 4WGF HX2 7.80488
233 4O9S 2RY 7.90698
234 4U98 ACP 7.9235
235 1PJ6 FOL 7.9235
236 5MTE BB2 8.0292
237 5D9G GLU ASN LEU TYR PHE GLN 8.13008
238 1LNM DTX 8.15217
239 1TQP ATP 8.15603
240 4R78 AMP 8.19672
241 1B7Y FYA 8.19672
242 1W6P NDG GAL 8.20895
243 5LXT ACP 8.46994
244 6DW2 HD4 8.62745
245 1NYW DAU 8.62944
246 1DZK PRZ 8.9172
247 2WOR 2AN 9
248 5VZ0 ADP 9.01639
249 4RYV ZEA 9.03226
250 4WW7 AMP 9.1954
251 5W7B MYR 9.21986
252 1NU4 MLA 9.27835
253 4PYA 2X3 9.31677
254 4FE2 AIR 9.41177
255 4LRJ ANP 9.46746
256 3QXV MTX 9.52381
257 5AE9 OKO 9.56284
258 1M0W ANP 9.56284
259 6HQD SRT 9.56284
260 6EZ6 C5Z 9.56284
261 6CDO ALA VAL GLY ILE GLY ALA VAL PHE 9.56522
262 4Q5H ANP 9.61539
263 4OGQ 2WD 9.67742
264 4OGQ UMQ 9.67742
265 3HAV ATP 9.699
266 6BXO SAH 9.78593
267 4NTO 1PW 10.1449
268 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 10.2041
269 5Y4R C2E 10.5442
270 3KP6 SAL 10.596
271 3WG3 A2G GAL NAG FUC 10.6742
272 5A96 GTP 10.8434
273 6GNO XDI 11.1111
274 6AC9 ANP 11.2022
275 6C1S EFV 11.2022
276 2RH1 CAU 11.2022
277 2BKK ADP 11.2426
278 5C03 AGS 11.4035
279 2VDF OCT 11.4625
280 4CYI ATP 11.7486
281 3E2M E2M 11.8919
282 3CF6 SP1 11.976
283 1S17 GNR 12.2222
284 4WOV 3SM 12.3028
285 3RV5 DXC 12.3596
286 5O1I 9GH 12.7854
287 1GT4 UNA 13.8365
288 1GEG GLC 14.8438
289 4FL3 ANP 15.0273
290 5K2M ADP 15.0943
291 5M06 ADP 15.2174
292 3AKK ADP 15.3846
293 5CKW ANP 15.5738
294 2HO2 PRO PRO PRO PRO PRO PRO PRO PRO PRO LEU 15.7895
295 2PZI AXX 15.847
296 5VNF VAL THR SER VAL VAL 15.9236
297 3H0L ADP 15.9574
298 2GC0 PAN 16.4894
299 5KEW 6SB 17.0213
300 5Z84 CHD 17.3913
301 5ZCO CHD 17.3913
302 3VHE 42Q 17.8273
303 2AGC DAO 18.5185
304 1G27 BB1 19.0476
305 3SRV S19 19.8556
306 2Y69 CHD 20
307 4F4P 0SB 20.1465
308 4WQM FAD 20.2454
309 3KMW ATP 20.6642
310 3PNA CMP 20.7792
311 4XH0 ADP 21.3115
312 5WNL STU 21.345
313 5VC5 96M 21.4533
314 6ES0 BW8 22.3975
315 4Y0X ADP 23.2
316 6GZD LCI 23.224
317 5W4W 9WG 23.565
318 4KBA 1QM 23.565
319 6BFN DL1 23.9766
320 2CSN CKI 24.2424
321 5OKT 9XK 24.5223
322 4G17 0VN 24.5455
323 5N1X 8HH 24.7934
324 5QIN J2V 25.3165
325 5T8O 76Z 25.5014
326 4E93 GUI 25.6831
327 3PP0 03Q 25.7396
328 4PNI KQQ 25.9563
329 4L9I 8PR 25.9563
330 6GWR FEW 26.0317
331 4IDT T28 26.1236
332 4P5Z Q7M 26.3158
333 3V8S 0HD 26.5027
334 2F2U M77 26.5027
335 4WNK 453 26.5027
336 4I94 ANP 26.6667
337 4Y8D 49J 26.7647
338 4IX4 ADP 26.8571
339 3C1X CKK 27.0492
340 2QLU ADE 27.0701
341 5MWE TCE 27.1429
342 3HMO STU 27.4854
343 4Y93 746 27.5956
344 4U44 3D9 27.7108
345 5HCY 60D 28.0967
346 3H9R TAK 28.1818
347 4EUU BX7 28.2132
348 4UAL 3FV 28.6885
349 4CLI 5P8 28.7462
350 5VCV 1N1 28.9389
351 5Y80 IRE 29.0735
352 6BXI ANP 29.1291
353 3UIM ANP 29.1411
354 5JGA 6KC 29.2063
355 5LPZ ADP 29.2169
356 3TKI S25 29.4118
357 2HY0 306 29.5031
358 5U6C 7YS 29.5238
359 5DBX ANP 29.5732
360 4OTH DRN 29.6188
361 3E8N ATP 29.6188
362 3E8N VRA 29.6188
363 4F9C 0SX 29.6399
364 5N87 N66 29.7125
365 1XJD STU 29.8551
366 4YMJ 4EJ 29.9342
367 2OO8 RAJ 29.9685
368 3M2W L8I 30.1003
369 4X7Q 3YR 30.1282
370 5MJA 7O3 30.1639
371 5JFS 6K0 30.1948
372 6C0T EE4 30.2594
373 5C9J DAO 30.303
374 2XVD AS6 30.4636
375 3NW7 LGV 30.6189
376 5KO1 6UY 30.7421
377 1JPA ANP 30.7692
378 4AT3 LTI 30.7692
379 3LXN MI1 30.8176
380 4WB7 ATP 30.8743
381 6GIN IR2 30.897
382 5EOB 5QQ 31.0345
383 1OPK P16 31.1475
384 3ORK AGS 31.1897
385 5HES 032 31.2704
386 5NKB 8ZT 31.3725
387 3PVW QRX 31.4208
388 5UKL SIX 31.4208
389 1K3A ACP 31.4381
390 4BTK DTQ 31.454
391 4OH4 ANP 31.5315
392 2Y6O 1N1 31.6151
393 3DLS ADP 31.6418
394 2QCS ANP 31.7143
395 5WO4 B7V 31.7881
396 3EKK GS2 31.9218
397 4Y85 499 31.9277
398 2H8H H8H 31.9672
399 1Y57 MPZ 31.9672
400 3VRY B43 31.9672
401 3FHI ANP 32
402 3IDB ANP 32
403 1RE8 BD2 32
404 6GQM F8H 32.0122
405 3BU5 ATP 32.0261
406 4UXL 5P8 32.2981
407 4BHN BH9 32.3353
408 4GJ3 0XP 32.4503
409 4FF8 14S 32.5077
410 3PLS ANP 32.5503
411 4WB6 ATP 32.5714
412 3MVH WFE 32.7485
413 2JDR L20 32.7485
414 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 32.7485
415 3KRL KRL 32.8358
416 4ASE AV9 32.8612
417 3GGF GVD 32.8904
418 4N70 2HX 32.9268
419 4E1Z 0MX 32.9897
420 2R5T ANP 33.0601
421 1U59 STU 33.101
422 5LPB ADP 33.1081
423 2WQN ADP 33.2258
424 4M69 ANP 33.2268
425 2GU8 796 33.2344
426 5TO8 7FM 33.3333
427 6CMJ F6J 33.3333
428 4G31 0WH 33.4448
429 4YZN 4K5 33.4495
430 6C7Y ADP 33.5664
431 3CY2 MB9 33.758
432 3LXK MI1 33.945
433 6CQF F97 34.0067
434 3GNI ATP 34.153
435 4EJN 0R4 34.153
436 4U0I 0LI 34.2857
437 4NFN 2KC 34.3042
438 4C2W ANP 34.4086
439 2PVF ACP 34.7305
440 3FHR P4O 34.8214
441 4RFM 3P6 34.9624
442 4YZC STU 34.9727
443 1VJY 460 34.9835
444 5CEO 50D 35
445 2A19 ANP 35.2113
446 1BYG STU 35.2518
447 4K33 ACP 35.3846
448 3SXS PP2 35.4478
449 5EH0 5NW 35.6589
450 4I6H 1C8 35.7143
451 5AX9 4KT 35.7143
452 1U5R ATP 35.9195
453 6E2O S0L 35.9322
454 4ITH RCM 36.0544
455 2RIO ADP 36.0656
456 6A1G 9OL 36.1111
457 3GQI ACP 36.1963
458 3BZ3 YAM 36.2319
459 6F3G CJN 36.2712
460 4C2V YJA 36.4912
461 4L3L 5FI 36.5132
462 4AG8 AXI 36.7089
463 5TA6 79D 36.8715
464 3RI1 3RH 37.0607
465 2YAB AMP 37.1191
466 5UIU 8CG 37.1517
467 4JR7 GNP 37.1585
468 5EYK 5U5 37.3188
469 5FBN 5WF 37.6384
470 4TWP AXI 37.6384
471 2J7T 274 37.7483
472 4EWH T77 37.8182
473 2ZV2 609 37.9195
474 5UR1 YY9 37.9421
475 3C0G 3AM 38.1766
476 3SLS ANP 38.4868
477 3HZT J60 38.7978
478 1IR3 ANP 38.8889
479 1ZY5 ANP 38.9439
480 2V7O DRN 38.9881
481 2WU6 DKI 39.071
482 3ALN ANP 39.1437
483 5JKG 6LF 39.2283
484 5UPK ANP 39.3064
485 3IGO ANP 39.3443
486 4ONA UW1 39.3443
487 2OFV 242 39.3502
488 3FC2 IBI 39.403
489 2X2M X2M 39.4904
490 1Q8Y ADP 39.6175
491 2WEL K88 40.367
492 3G5D 1N1 40.5594
493 4XV1 904 40.7534
494 5LVP ATP 40.836
495 4A4X JUP 40.8602
496 4BFM ANP 41.018
497 5L8L ADP 41.0526
498 5G1X ADP 41.0526
499 2Z7R STU 41.1215
500 5IH9 6BF 41.194
501 3KN5 ANP 41.2308
502 5ODT ADP 41.3428
503 5LXM ADP 41.3428
504 3RWP ABQ 41.4791
505 2VZ6 FEF 41.5335
506 5MY8 RXZ 41.8033
507 4USF 6UI 42.1053
508 5H2U 1N1 42.3221
509 6FYL 3NG 42.4242
510 4CSV STI 42.5455
511 2F57 23D 42.5868
512 5Y86 HRM 42.623
513 6CZ3 FLJ 42.803
514 5EW9 5VC 42.8044
515 4CQE CQE 42.8058
516 4QMN DB8 42.9032
517 5LI1 ANP 42.9379
518 4NST ADP 43.3048
519 4NST AF3 43.3048
520 2HK5 1BM 43.3333
521 4NW6 2NS 43.3437
522 5LI9 ACP 43.4286
523 5X8I SQZ 43.6416
524 3E5A VX6 43.6567
525 4FG8 ATP 43.8095
526 2VN9 GVD 43.8538
527 5DRB 5FJ 43.9863
528 5OMY 9YE 43.9898
529 5DEY 59T 44.1077
530 5ZTN CUR 44.2623
531 4IJP 1EH 44.4134
532 4CRL C1I 44.5355
533 6G33 5ID 44.5428
534 3ZRM ZRM 44.8087
535 4NM5 ADP 45.3581
536 6FYV 3NG 45.4006
537 4KS7 X4Z 45.5479
538 1PHK ATP 45.6376
539 4WNP 3RJ 45.993
540 5EFQ ADP 46.1095
541 3DAK ANP 46.5517
542 2JLD AG1 46.7213
543 3F7Z 34O 46.8571
544 5DH3 5BS 46.9841
545 5XVG 8FX 47.099
546 1O9U ADZ 47.7143
547 3GC0 AMP 47.7204
548 5JZJ AN2 47.8114
549 1EB1 ASP TYR GLU PRO ILE PRO GLU GLU ALA PHE 48.1481
550 2PVN P63 49.1477
551 5A6N U7E 49.47
552 2WEI VGG 49.4774
553 5YF9 NIO 49.5575
554 2XK9 XK9 50
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