Receptor
PDB id Resolution Class Description Source Keywords
5FPB 1.91 Å EC: 1.14.11.- CRYSTAL STRUCTURE OF HUMAN KDM4D IN COMPLEX WITH 2-1H- PYRAZOL-4-YLOXY-3H,4H-PYRIDO-3,4-D-PYRIMIDIN-4-ONE HOMO SAPIENS OXIDOREDUCTASE INHIBITOR LYSINE SPECIFIC HISTONE DEMETHYLAJMJD2D KDM4D JUMONJI
Ref.: CELL PENETRANT INHIBITORS OF THE KDM4 AND KDM5 FAMI HISTONE LYSINE DEMETHYLASES. 1. 3-AMINO-4-PYRIDINE CARBOXYLATE DERIVATIVES. J.MED.CHEM. V. 59 1357 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
SO4 A:1342;
A:1346;
A:1344;
A:1345;
A:1347;
A:1343;
A:1348;
 Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
 none;
none;
none;
none;
none;
none;
none;
 submit data
96.063 O4 S [O-]S...
CO A:360;
 Part of Protein;
 none;
 submit data
58.933 Co [Co+2...
HA6 A:1341;
 Valid;
 none;
 submit data
229.195 C10 H7 N5 O2 c1cnc...
ZN A:350;
 Part of Protein;
 none;
 submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5FP4 2 Å EC: 1.14.11.- CRYSTAL STRUCTURE OF HUMAN KDM4D IN COMPLEX WITH 3-(4- PHENYLBUTANAMIDO)PYRIDINE-4-CARBOXYLIC ACID HOMO SAPIENS TRANSCRIPTION INHIBITOR LYSINE SPECIFIC HISTONE DEMETHYLASJMJD2D KDM4D JUMONJI
Ref.: CELL PENETRANT INHIBITORS OF THE KDM4 AND KDM5 FAMI HISTONE LYSINE DEMETHYLASES. 1. 3-AMINO-4-PYRIDINE CARBOXYLATE DERIVATIVES. J.MED.CHEM. V. 59 1357 2016
Members (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 43 families.
1 5FP4 ic50 = 0.251 uM YC8 C16 H16 N2 O3 c1ccc(cc1)....
2 5FP7 - YC8 C16 H16 N2 O3 c1ccc(cc1)....
3 5F5C - 5V3 C15 H14 N4 O c1ccc(cc1)....
4 5FP8 - AUY C12 H12 N2 O2 S Cc1cc(sc1)....
5 5F5A - 5V0 C12 H12 N2 O3 c1cc(oc1)C....
6 5FP9 ic50 = 1.585 uM 4SV C6 H6 N2 O2 c1cncc(c1C....
7 5FPA - N5J C7 H5 N3 O c1cncc2c1C....
8 5FPB - HA6 C10 H7 N5 O2 c1cncc2c1C....
9 4HON - THR ALA ARG M3L SER THR GLY GLY LYS ALA n/a n/a
70% Homology Family (49)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 31 families.
1 6H4T Ki = 0.004 uM FOW C25 H26 N6 O c1ccc2c(c1....
2 5A7P - 6Z1 C17 H13 N3 O5 Cc1cc(no1)....
3 5ANQ ic50 = 3.98 uM 5YQ C16 H13 N5 O2 c1cc(cnc1)....
4 6H4Q ic50 = 2.06 uM FO2 C16 H18 N6 O CN1CCC(CC1....
5 2OQ6 - OGA C4 H5 N O5 C(C(=O)O)N....
6 2OX0 - OGA C4 H5 N O5 C(C(=O)O)N....
7 6H4S Ki = 0.002 uM FQE C27 H33 N7 O CN(C)CCc1c....
8 5F3G ic50 = 0.126 uM 5UL C24 H25 Cl N6 O c1cc(ccc1C....
9 5A7Q - KCH C12 H10 N2 O3 c1cc(c(cc1....
10 6H4P Ki = 0.003 uM FQ5 C23 H23 Cl N6 O c1cc(cc(c1....
11 5A7N - VAO C13 H8 N2 O3 c1cc(c(cc1....
12 5F3E ic50 = 0.138 uM 5UO C23 H23 Cl N6 O c1cc(ccc1C....
13 2GP5 - AKG C5 H6 O5 C(CC(=O)O)....
14 6H4V ic50 = 0.613 uM FQN C20 H24 N6 O c1cnc(c2c1....
15 6H4O ic50 = 0.128 uM FQH C24 H23 F3 N6 O c1cc(cc(c1....
16 2OT7 - OGA C4 H5 N O5 C(C(=O)O)N....
17 6H4U - FO2 C16 H18 N6 O CN1CCC(CC1....
18 5A7S - S2X C14 H12 N2 O4 CC(=O)Nc1c....
19 6H4R Ki = 0.004 nM FQB C27 H33 N7 O CN(C)CCc1c....
20 4AI9 - DZA C6 H12 N2 O3 CN(C)NC(=O....
21 3U4S Ki = 114 nM ALA ARG M3L SER CYS GLY GLY LYS 08P n/a n/a
22 3PDQ ic50 = 0.18 uM KC6 C14 H14 N4 O3 c1cnc(cc1C....
23 5F3C ic50 = 0.9 uM 5U8 C20 H19 F N6 O CN(CCc1cnn....
24 5F32 ic50 = 11.5 uM 5V7 C10 H7 N5 O S c1cnc(c2c1....
25 4URA ic50 = 0.00000316 uM LEL C8 H6 N4 O2 c1cnc(cc1C....
26 5F2S ic50 = 0.2 uM 5TZ C9 H7 N3 O2 S c1cnc(cc1C....
27 2YBK ic50 = 24 uM 2HG C5 H8 O5 C(CC(=O)O)....
28 5TVR - AKG C5 H6 O5 C(CC(=O)O)....
29 5A80 - 9CJ C21 H18 N2 O5 COc1cccc(c....
30 6H4Y ic50 = 0.077 uM FO8 C29 H35 N7 O2 c1cc(ccc1C....
31 5A7O - 7WH C15 H14 N2 O5 COCC(=O)Nc....
32 6CG1 - QC1 C13 H11 F N2 O2 c1cc(ccc1C....
33 5F37 ic50 = 1.7 uM N5J C7 H5 N3 O c1cncc2c1C....
34 6H4X ic50 = 0.131 uM FNQ C28 H27 N7 O c1cc(cnc1)....
35 6CG2 - QC2 C15 H11 N3 O3 c1cc(cc(c1....
36 2OQ7 - OGA C4 H5 N O5 C(C(=O)O)N....
37 5FPV - MMK C15 H22 N4 O3 CCN(/C=C/N....
38 5F3I ic50 = 0.08 uM 5UJ C23 H22 Cl2 N6 O c1cnc(c2c1....
39 5KR7 ic50 = 2.88 uM 6X9 C11 H12 N4 O CCC1=C(Nc2....
40 4XDO ic50 = 84 uM OGA C4 H5 N O5 C(C(=O)O)N....
41 5FP4 ic50 = 0.251 uM YC8 C16 H16 N2 O3 c1ccc(cc1)....
42 5FP7 - YC8 C16 H16 N2 O3 c1ccc(cc1)....
43 5F5C - 5V3 C15 H14 N4 O c1ccc(cc1)....
44 5FP8 - AUY C12 H12 N2 O2 S Cc1cc(sc1)....
45 5F5A - 5V0 C12 H12 N2 O3 c1cc(oc1)C....
46 5FP9 ic50 = 1.585 uM 4SV C6 H6 N2 O2 c1cncc(c1C....
47 5FPA - N5J C7 H5 N3 O c1cncc2c1C....
48 5FPB - HA6 C10 H7 N5 O2 c1cncc2c1C....
49 4HON - THR ALA ARG M3L SER THR GLY GLY LYS ALA n/a n/a
50% Homology Family (50)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 28 families.
1 6H4T Ki = 0.004 uM FOW C25 H26 N6 O c1ccc2c(c1....
2 5A7P - 6Z1 C17 H13 N3 O5 Cc1cc(no1)....
3 5ANQ ic50 = 3.98 uM 5YQ C16 H13 N5 O2 c1cc(cnc1)....
4 6H4Q ic50 = 2.06 uM FO2 C16 H18 N6 O CN1CCC(CC1....
5 2OQ6 - OGA C4 H5 N O5 C(C(=O)O)N....
6 2OX0 - OGA C4 H5 N O5 C(C(=O)O)N....
7 6H4S Ki = 0.002 uM FQE C27 H33 N7 O CN(C)CCc1c....
8 5F3G ic50 = 0.126 uM 5UL C24 H25 Cl N6 O c1cc(ccc1C....
9 5A7Q - KCH C12 H10 N2 O3 c1cc(c(cc1....
10 6H4P Ki = 0.003 uM FQ5 C23 H23 Cl N6 O c1cc(cc(c1....
11 5A7N - VAO C13 H8 N2 O3 c1cc(c(cc1....
12 5F3E ic50 = 0.138 uM 5UO C23 H23 Cl N6 O c1cc(ccc1C....
13 2GP5 - AKG C5 H6 O5 C(CC(=O)O)....
14 6H4V ic50 = 0.613 uM FQN C20 H24 N6 O c1cnc(c2c1....
15 6H4O ic50 = 0.128 uM FQH C24 H23 F3 N6 O c1cc(cc(c1....
16 2OT7 - OGA C4 H5 N O5 C(C(=O)O)N....
17 6H4U - FO2 C16 H18 N6 O CN1CCC(CC1....
18 5A7S - S2X C14 H12 N2 O4 CC(=O)Nc1c....
19 6H4R Ki = 0.004 nM FQB C27 H33 N7 O CN(C)CCc1c....
20 4AI9 - DZA C6 H12 N2 O3 CN(C)NC(=O....
21 3U4S Ki = 114 nM ALA ARG M3L SER CYS GLY GLY LYS 08P n/a n/a
22 3PDQ ic50 = 0.18 uM KC6 C14 H14 N4 O3 c1cnc(cc1C....
23 5F3C ic50 = 0.9 uM 5U8 C20 H19 F N6 O CN(CCc1cnn....
24 5F32 ic50 = 11.5 uM 5V7 C10 H7 N5 O S c1cnc(c2c1....
25 4URA ic50 = 0.00000316 uM LEL C8 H6 N4 O2 c1cnc(cc1C....
26 5F2S ic50 = 0.2 uM 5TZ C9 H7 N3 O2 S c1cnc(cc1C....
27 2YBK ic50 = 24 uM 2HG C5 H8 O5 C(CC(=O)O)....
28 5TVR - AKG C5 H6 O5 C(CC(=O)O)....
29 5A80 - 9CJ C21 H18 N2 O5 COc1cccc(c....
30 6H4Y ic50 = 0.077 uM FO8 C29 H35 N7 O2 c1cc(ccc1C....
31 5A7O - 7WH C15 H14 N2 O5 COCC(=O)Nc....
32 6CG1 - QC1 C13 H11 F N2 O2 c1cc(ccc1C....
33 5F37 ic50 = 1.7 uM N5J C7 H5 N3 O c1cncc2c1C....
34 6H4X ic50 = 0.131 uM FNQ C28 H27 N7 O c1cc(cnc1)....
35 6CG2 - QC2 C15 H11 N3 O3 c1cc(cc(c1....
36 2OQ7 - OGA C4 H5 N O5 C(C(=O)O)N....
37 5FPV - MMK C15 H22 N4 O3 CCN(/C=C/N....
38 5F3I ic50 = 0.08 uM 5UJ C23 H22 Cl2 N6 O c1cnc(c2c1....
39 3OPT - AKG C5 H6 O5 C(CC(=O)O)....
40 5KR7 ic50 = 2.88 uM 6X9 C11 H12 N4 O CCC1=C(Nc2....
41 4XDO ic50 = 84 uM OGA C4 H5 N O5 C(C(=O)O)N....
42 5FP4 ic50 = 0.251 uM YC8 C16 H16 N2 O3 c1ccc(cc1)....
43 5FP7 - YC8 C16 H16 N2 O3 c1ccc(cc1)....
44 5F5C - 5V3 C15 H14 N4 O c1ccc(cc1)....
45 5FP8 - AUY C12 H12 N2 O2 S Cc1cc(sc1)....
46 5F5A - 5V0 C12 H12 N2 O3 c1cc(oc1)C....
47 5FP9 ic50 = 1.585 uM 4SV C6 H6 N2 O2 c1cncc(c1C....
48 5FPA - N5J C7 H5 N3 O c1cncc2c1C....
49 5FPB - HA6 C10 H7 N5 O2 c1cncc2c1C....
50 4HON - THR ALA ARG M3L SER THR GLY GLY LYS ALA n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: HA6; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 HA6 1 1
2 GZA 0.5 0.844828
3 M6N 0.412698 0.603774
Similar Ligands (3D)
Ligand no: 1; Ligand: HA6; Similar ligands found: 606
No: Ligand Similarity coefficient
1 H35 0.9621
2 1Q4 0.9489
3 EXR 0.9414
4 3AK 0.9397
5 CHQ 0.9386
6 B21 0.9370
7 9F8 0.9362
8 5WT 0.9352
9 I2E 0.9350
10 2L1 0.9349
11 4EU 0.9331
12 F40 0.9326
13 EVO 0.9325
14 BIE 0.9314
15 78P 0.9312
16 6XC 0.9297
17 GZV 0.9294
18 2GQ 0.9291
19 536 0.9287
20 ZIP 0.9278
21 F91 0.9272
22 TRP 0.9265
23 5WN 0.9262
24 2L2 0.9257
25 FER 0.9255
26 5F8 0.9246
27 UN4 0.9242
28 VJJ 0.9238
29 A4V 0.9236
30 CUT 0.9235
31 LI7 0.9232
32 CUH 0.9232
33 5FL 0.9229
34 C4E 0.9224
35 7ZO 0.9219
36 ZEZ 0.9214
37 5NN 0.9214
38 EYY 0.9209
39 MW5 0.9208
40 BZM 0.9207
41 3IB 0.9204
42 EYM 0.9202
43 DXK 0.9200
44 YEX 0.9199
45 Q5M 0.9198
46 7L4 0.9196
47 MBP 0.9188
48 7PJ 0.9187
49 FNA 0.9186
50 6DQ 0.9183
51 ZEA 0.9182
52 EXG 0.9176
53 ELH 0.9169
54 QUB 0.9168
55 B5A 0.9166
56 LL1 0.9162
57 4Z9 0.9159
58 4Z1 0.9155
59 FCD 0.9155
60 CMG 0.9154
61 1AJ 0.9153
62 P83 0.9150
63 LP8 0.9149
64 G30 0.9143
65 IQQ 0.9136
66 KYN 0.9134
67 IOP 0.9132
68 TCR 0.9130
69 QTV 0.9128
70 SJK 0.9127
71 12R 0.9125
72 P4L 0.9124
73 96Z 0.9120
74 22L 0.9118
75 3D8 0.9115
76 5ER 0.9114
77 B4L 0.9112
78 ZME 0.9112
79 EV2 0.9111
80 EMU 0.9111
81 C0W 0.9107
82 C09 0.9106
83 ITW 0.9104
84 9BF 0.9103
85 WCU 0.9103
86 0J5 0.9100
87 YE7 0.9099
88 8G6 0.9099
89 B23 0.9098
90 3GX 0.9098
91 RK4 0.9097
92 57D 0.9096
93 5V6 0.9094
94 531 0.9093
95 YE6 0.9093
96 RVE 0.9092
97 9VQ 0.9090
98 5F5 0.9088
99 HBI 0.9088
100 D87 0.9088
101 6JO 0.9087
102 KWB 0.9086
103 PLP 0.9086
104 RKV 0.9085
105 JTF 0.9085
106 5P3 0.9083
107 WA2 0.9080
108 L3L 0.9079
109 2UD 0.9075
110 FPL 0.9075
111 7VF 0.9075
112 7I2 0.9074
113 EUH 0.9073
114 BC3 0.9072
115 6C9 0.9071
116 MD6 0.9070
117 D1Y 0.9070
118 Q9P 0.9070
119 MJ5 0.9069
120 SYE 0.9069
121 LI4 0.9068
122 G6P 0.9068
123 VM1 0.9068
124 PQT 0.9066
125 774 0.9063
126 5WS 0.9063
127 5V5 0.9062
128 0J4 0.9060
129 6C5 0.9057
130 A73 0.9054
131 25F 0.9054
132 XG1 0.9053
133 DTR 0.9053
134 5V7 0.9052
135 7ZL 0.9052
136 PMP 0.9050
137 BUX 0.9049
138 WV7 0.9048
139 GNR 0.9047
140 AMR 0.9047
141 OSB 0.9046
142 HWH 0.9044
143 9E3 0.9043
144 AJD 0.9040
145 FC3 0.9039
146 NFZ 0.9038
147 CX4 0.9037
148 WLH 0.9036
149 0QV 0.9036
150 MUX 0.9035
151 DFL 0.9032
152 R4E 0.9031
153 D80 0.9029
154 LJ4 0.9029
155 PW1 0.9029
156 Z25 0.9025
157 3JC 0.9025
158 1CE 0.9023
159 NAR 0.9022
160 848 0.9022
161 3WJ 0.9022
162 HLP 0.9022
163 BBY 0.9021
164 L21 0.9019
165 4VT 0.9018
166 EYA 0.9018
167 NIP 0.9018
168 5AD 0.9018
169 9XZ 0.9017
170 QR2 0.9017
171 0OO 0.9016
172 27M 0.9016
173 1V1 0.9015
174 NTF 0.9014
175 5C1 0.9013
176 NWD 0.9011
177 3SU 0.9008
178 3B4 0.9007
179 4P8 0.9005
180 28S 0.9004
181 EQA 0.9004
182 CH8 0.9003
183 5TO 0.9001
184 UN9 0.9001
185 OX2 0.9000
186 L5D 0.9000
187 20D 0.9000
188 9JH 0.8999
189 AUV 0.8999
190 P9I 0.8999
191 M5H 0.8998
192 8Y7 0.8998
193 BL7 0.8998
194 NAL 0.8998
195 4K2 0.8997
196 E9S 0.8997
197 JP2 0.8996
198 TYP 0.8994
199 QMS 0.8992
200 MN QAY 0.8990
201 7M5 0.8988
202 3EB 0.8987
203 3IP 0.8985
204 H4B 0.8985
205 G1P 0.8984
206 PMM 0.8984
207 1V4 0.8983
208 AC2 0.8982
209 78U 0.8980
210 5E4 0.8976
211 9CE 0.8975
212 JA3 0.8975
213 TCW 0.8974
214 92O 0.8974
215 FUZ 0.8970
216 AX5 0.8970
217 EY2 0.8968
218 1V3 0.8967
219 LTN 0.8967
220 B2E 0.8967
221 ET0 0.8965
222 0OM 0.8965
223 X0T 0.8964
224 AEY 0.8960
225 KLV 0.8959
226 4AU 0.8955
227 IKY 0.8955
228 L07 0.8954
229 3Y7 0.8954
230 GNV 0.8952
231 PXP 0.8952
232 TI7 0.8950
233 NIY 0.8947
234 B61 0.8943
235 NEO 0.8943
236 4F8 0.8942
237 SLY 0.8942
238 ONZ 0.8942
239 3IL 0.8941
240 RUG 0.8941
241 DDC 0.8941
242 4FF 0.8941
243 TQL 0.8939
244 6J5 0.8939
245 IXG 0.8935
246 NPX 0.8935
247 KOM 0.8934
248 NW1 0.8932
249 FT6 0.8930
250 2QU 0.8928
251 DE7 0.8927
252 4L2 0.8927
253 9KZ 0.8924
254 GXG 0.8923
255 MQS 0.8923
256 WL3 0.8922
257 AZY 0.8921
258 M01 0.8921
259 5E5 0.8920
260 R9G 0.8917
261 RNK 0.8916
262 5WM 0.8916
263 M77 0.8916
264 GI4 0.8915
265 6QT 0.8914
266 P2L 0.8913
267 69K 0.8911
268 KTM 0.8910
269 BIO 0.8910
270 WVV 0.8908
271 2NJ 0.8906
272 LQG 0.8906
273 XJ2 0.8905
274 KP2 0.8905
275 F5C 0.8904
276 GXD 0.8902
277 NIR 0.8901
278 22T 0.8901
279 DIH 0.8899
280 D9Z 0.8896
281 Q4G 0.8896
282 LWS 0.8895
283 AVX 0.8895
284 4GP 0.8894
285 67Y 0.8894
286 ASE 0.8894
287 0FR 0.8893
288 FC2 0.8893
289 M3W 0.8893
290 54X 0.8892
291 KF5 0.8892
292 H7S 0.8891
293 AVA 0.8889
294 EWG 0.8888
295 M02 0.8887
296 NIF 0.8887
297 HHV 0.8885
298 JVD 0.8884
299 MPP 0.8882
300 5OF 0.8881
301 JE7 0.8881
302 JTA 0.8881
303 1U7 0.8878
304 TJM 0.8878
305 S7V 0.8877
306 VT3 0.8877
307 XFE 0.8875
308 7AP 0.8874
309 NEU 0.8873
310 7PS 0.8872
311 BIK 0.8872
312 H2B 0.8871
313 FNT 0.8871
314 GA2 0.8870
315 8OB 0.8870
316 6ZW 0.8870
317 AYS 0.8869
318 4GU 0.8869
319 KU1 0.8869
320 O82 0.8869
321 SSY 0.8867
322 30G 0.8867
323 8OE 0.8867
324 BG6 0.8867
325 JXT 0.8866
326 ZYV 0.8866
327 4MP 0.8863
328 A4G 0.8862
329 II4 0.8862
330 CUQ 0.8861
331 XEZ 0.8860
332 B41 0.8860
333 LRW 0.8860
334 GHQ 0.8860
335 PYU 0.8858
336 C0H 0.8858
337 TQ1 0.8857
338 7MX 0.8855
339 JXQ 0.8854
340 96R 0.8854
341 1HR 0.8853
342 GI2 0.8852
343 SCE 0.8852
344 PLR 0.8849
345 9UL 0.8848
346 NPS 0.8848
347 64E 0.8845
348 SQV 0.8844
349 4NR 0.8843
350 Q0K 0.8841
351 XI7 0.8841
352 GO8 0.8841
353 HVE 0.8840
354 ENG 0.8839
355 4R1 0.8838
356 MXD 0.8838
357 HH6 0.8837
358 BSA 0.8836
359 M3Q 0.8836
360 AKD 0.8835
361 5WK 0.8833
362 HKK 0.8833
363 P93 0.8832
364 5UH 0.8832
365 5JT 0.8831
366 CC6 0.8831
367 X04 0.8830
368 BB4 0.8829
369 43F 0.8828
370 A7K 0.8827
371 49P 0.8826
372 JYE 0.8823
373 CTE 0.8823
374 BGP 0.8822
375 NU3 0.8821
376 52F 0.8820
377 BQ2 0.8817
378 6HP 0.8816
379 5M2 0.8816
380 55D 0.8815
381 TOP 0.8815
382 AUY 0.8814
383 ADN 0.8814
384 KCH 0.8813
385 DFV 0.8812
386 8RK 0.8811
387 O2Y 0.8810
388 3WK 0.8809
389 LLG 0.8806
390 1ER 0.8806
391 KMP 0.8805
392 363 0.8803
393 22F 0.8802
394 NYJ 0.8801
395 PE2 0.8800
396 5TZ 0.8800
397 EYJ 0.8799
398 2LT 0.8797
399 1QP 0.8795
400 PZX 0.8793
401 RKY 0.8793
402 BDI 0.8792
403 4AB 0.8792
404 HMZ 0.8791
405 1X8 0.8791
406 DBE 0.8791
407 LVE 0.8789
408 TCL 0.8786
409 7NU 0.8785
410 MPU 0.8785
411 DCN 0.8785
412 PTB 0.8785
413 BL6 0.8785
414 C4F 0.8784
415 2JX 0.8783
416 0H5 0.8782
417 C0Y 0.8778
418 11X 0.8777
419 O9Q 0.8776
420 3D1 0.8775
421 5F1 0.8775
422 GJG 0.8772
423 6J9 0.8770
424 ML1 0.8769
425 8HG 0.8768
426 6PB 0.8767
427 DBS 0.8767
428 5AV 0.8766
429 DHC 0.8763
430 25O 0.8763
431 TLF 0.8762
432 MDR 0.8760
433 GJK 0.8760
434 NPL 0.8759
435 S7G 0.8757
436 U7E 0.8757
437 CC5 0.8756
438 ZSP 0.8755
439 BIT 0.8754
440 Q8G 0.8754
441 4BX 0.8753
442 SZA 0.8752
443 FY8 0.8750
444 IQ5 0.8748
445 Q9T 0.8748
446 2LW 0.8748
447 657 0.8746
448 4JV 0.8745
449 9ME 0.8744
450 CX5 0.8744
451 QC1 0.8742
452 6C8 0.8741
453 QEI 0.8739
454 C9E 0.8738
455 JHY 0.8738
456 X6P 0.8736
457 0GA 0.8734
458 6J3 0.8734
459 CR1 0.8734
460 FCW 0.8734
461 0RY 0.8732
462 BL4 0.8731
463 ETV 0.8731
464 YIE 0.8730
465 EAJ 0.8730
466 5I5 0.8729
467 MS0 0.8728
468 56N 0.8726
469 B4O 0.8724
470 NPA 0.8720
471 MQR 0.8718
472 JTY 0.8718
473 54F 0.8718
474 N1Y 0.8717
475 3TC 0.8716
476 N1E 0.8716
477 B52 0.8714
478 6TJ 0.8712
479 V2Z 0.8711
480 RGG 0.8709
481 H48 0.8709
482 QIF 0.8709
483 FSU 0.8709
484 THM 0.8708
485 BZC 0.8707
486 XYS XYS 0.8705
487 1QV 0.8705
488 EYV 0.8701
489 CDY 0.8700
490 IOS 0.8698
491 3AD 0.8696
492 QTD 0.8694
493 ALR 0.8692
494 0SX 0.8692
495 GI1 0.8690
496 8HH 0.8690
497 5PK 0.8686
498 DUR 0.8684
499 GNJ 0.8684
500 7XX 0.8681
501 A18 0.8680
502 2H4 0.8678
503 CPW 0.8677
504 F63 0.8677
505 JY2 0.8676
506 M78 0.8671
507 2P3 0.8671
508 3VW 0.8671
509 SNB 0.8669
510 LTT 0.8668
511 K68 0.8668
512 GLP 0.8665
513 HBO 0.8665
514 PVQ 0.8660
515 ID8 0.8660
516 IM4 0.8660
517 MEX 0.8660
518 5XL 0.8659
519 GZ2 0.8658
520 JSX 0.8656
521 KYA 0.8656
522 JFS 0.8655
523 Q8D 0.8654
524 F0C 0.8653
525 1YO 0.8652
526 N2M 0.8652
527 6NZ 0.8651
528 3L1 0.8651
529 XEV 0.8651
530 J38 0.8650
531 9RM 0.8648
532 32V 0.8646
533 9X3 0.8646
534 AZC 0.8644
535 TIA 0.8643
536 5GT 0.8642
537 CSN 0.8642
538 CHV 0.8640
539 M9N 0.8639
540 0QA 0.8637
541 ABF 0.8637
542 LLT 0.8634
543 S1D 0.8629
544 74Z 0.8627
545 X2M 0.8626
546 D2G 0.8623
547 FB4 0.8621
548 NLA 0.8621
549 AH3 0.8621
550 PVK 0.8620
551 S0F 0.8619
552 D1G 0.8619
553 BGK 0.8619
554 OA1 0.8618
555 5R9 0.8614
556 ZYW 0.8614
557 5SJ 0.8612
558 LVY 0.8612
559 6EL 0.8610
560 SXX 0.8608
561 AH9 0.8603
562 M6D 0.8600
563 UAY 0.8599
564 TCC 0.8599
565 STT 0.8599
566 4I8 0.8598
567 FF2 0.8597
568 I59 0.8597
569 NPG 0.8594
570 GT1 0.8594
571 MP5 0.8592
572 N2Y 0.8591
573 5KN 0.8591
574 UN3 0.8590
575 SNJ 0.8590
576 4RV 0.8583
577 FT1 0.8583
578 6DP 0.8583
579 FTU 0.8582
580 27K 0.8582
581 EMF 0.8579
582 FT2 0.8578
583 GAT 0.8578
584 QD0 0.8577
585 CGW 0.8576
586 29B 0.8575
587 A04 0.8572
588 JPB 0.8572
589 RPN 0.8567
590 EY7 0.8567
591 109 0.8562
592 PLP PMP 0.8561
593 3DT 0.8559
594 S46 0.8559
595 NBG 0.8553
596 NOS 0.8552
597 A8K 0.8552
598 U19 0.8551
599 QNM 0.8550
600 J47 0.8550
601 NQE 0.8546
602 ZHA 0.8535
603 HX8 0.8531
604 JOH 0.8529
605 SRO 0.8520
606 GNG 0.8520
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5FP4; Ligand: YC8; Similar sites found with APoc: 1
This union binding pocket(no: 1) in the query (biounit: 5fp4.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 6IP0 AKG 43.7126
Pocket No.: 2; Query (leader) PDB : 5FP4; Ligand: YC8; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 5fp4.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback