Receptor
PDB id Resolution Class Description Source Keywords
4Z6H 1.8 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF BRD9 BROMODOMAIN IN COMPLEX WITH A VALE QUINOLONE LIGAND HOMO SAPIENS LYSINE-ACETYLATED HISTONE BINDING CHROMATIN REGULATOR TRANSCRIPTION BROMODOMAIN STRUCTURAL GENOMICS STRUCTURALCONSORTIUM SGC
Ref.: LP99: DISCOVERY AND SYNTHESIS OF THE FIRST SELECTIV BROMODOMAIN INHIBITOR. ANGEW.CHEM.INT.ED.ENGL. V. 54 6217 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
4L2 B:201;
A:201;
Valid;
Valid;
none;
none;
Kd = 612 nM
270.326 C16 H18 N2 O2 CC1=C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5F1H 1.82 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE BRD9 BROMODAMIAN IN COMPLEX WITH BI HOMO SAPIENS BROMODOMAIN INHIBITOR TRANSCRIPTION
Ref.: STRUCTURE-BASED DESIGN OF AN IN VIVO ACTIVE SELECTI INHIBITOR. J.MED.CHEM. V. 59 4462 2016
Members (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 6V1B Kd = 37 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
2 6V0X Kd = 277 uM B49 C22 H27 F N4 O2 CCN(CC)CCN....
3 4XY8 Kd = 397 nM 43U C12 H10 Br N5 O COc1ccc(cc....
4 5IGM Kd = 41.7 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
5 4Z6H Kd = 612 nM 4L2 C16 H18 N2 O2 CC1=CC(=O)....
6 6HM0 Kd = 73 nM GBW C50 H64 N8 O9 S Cc1c(scn1)....
7 5F1H Kd = 14.1 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
8 5F1L ic50 = 21 nM 5U2 C19 H24 N2 O4 CC1=CC(=CN....
9 5F25 Kd = 9.1 uM 5TU C14 H14 N2 O2 CC1=CC(=CN....
10 4Z6I - 4L3 C27 H31 N3 O4 CC1=CC(=O)....
11 6V0S Kd = 16000 nM EAE C13 H15 N O2 S CCN1c2cc(c....
12 5EU1 Kd = 15.4 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
13 6V14 Kd = 82 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
14 5F2P Kd = 37.5 uM 5TY C10 H12 N4 O CN1C=Cc2c(....
70% Homology Family (29)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 5I7Y Kd = 52 nM 69G C20 H21 N3 O2 C/C=C/CN1C....
2 4UIW ic50 = 0.00000001 M H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
3 4UIV ic50 = 0.00000001 M XZB C21 H20 F3 N3 O3 S2 CN1C=C(c2c....
4 5JI8 Kd = 23.4 uM 6KT C8 H7 N3 O S c1cc2c(cc1....
5 5MKY ic50 = 2 uM I0D C15 H17 Cl N4 O CN1CCc2c(c....
6 4UIU ic50 = 0.00000001 M TVU C22 H24 N2 O6 S2 CN1C=C(c2c....
7 4UIT ic50 = 0.00000001 M N1D C22 H25 N3 O6 S2 CN1C=C(c2c....
8 5I40 ic50 = 13.7 uM 67N C8 H8 N2 O CN1C=Cc2cc....
9 5I7X Kd = 53 nM 67B C17 H17 N3 O2 CN1C=C(c2c....
10 6V1B Kd = 37 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
11 6V0X Kd = 277 uM B49 C22 H27 F N4 O2 CCN(CC)CCN....
12 4XY8 Kd = 397 nM 43U C12 H10 Br N5 O COc1ccc(cc....
13 5IGM Kd = 41.7 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
14 4Z6H Kd = 612 nM 4L2 C16 H18 N2 O2 CC1=CC(=O)....
15 6HM0 Kd = 73 nM GBW C50 H64 N8 O9 S Cc1c(scn1)....
16 5F1H Kd = 14.1 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
17 5F1L ic50 = 21 nM 5U2 C19 H24 N2 O4 CC1=CC(=CN....
18 5F25 Kd = 9.1 uM 5TU C14 H14 N2 O2 CC1=CC(=CN....
19 4Z6I - 4L3 C27 H31 N3 O4 CC1=CC(=O)....
20 6V0S Kd = 16000 nM EAE C13 H15 N O2 S CCN1c2cc(c....
21 5EU1 Kd = 15.4 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
22 6V14 Kd = 82 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
23 5F2P Kd = 37.5 uM 5TY C10 H12 N4 O CN1C=Cc2c(....
24 6V1E Kd = 121 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
25 6V17 Kd = 148 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
26 6V0Q Kd = 4200 nM EAE C13 H15 N O2 S CCN1c2cc(c....
27 6V1H Kd = 114 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
28 6V16 Kd = 556 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
29 6V1F Kd = 418 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
50% Homology Family (64)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 5I7Y Kd = 52 nM 69G C20 H21 N3 O2 C/C=C/CN1C....
2 4UIW ic50 = 0.00000001 M H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
3 4UIV ic50 = 0.00000001 M XZB C21 H20 F3 N3 O3 S2 CN1C=C(c2c....
4 5JI8 Kd = 23.4 uM 6KT C8 H7 N3 O S c1cc2c(cc1....
5 5MKY ic50 = 2 uM I0D C15 H17 Cl N4 O CN1CCc2c(c....
6 4UIU ic50 = 0.00000001 M TVU C22 H24 N2 O6 S2 CN1C=C(c2c....
7 4UIT ic50 = 0.00000001 M N1D C22 H25 N3 O6 S2 CN1C=C(c2c....
8 5I40 ic50 = 13.7 uM 67N C8 H8 N2 O CN1C=Cc2cc....
9 5I7X Kd = 53 nM 67B C17 H17 N3 O2 CN1C=C(c2c....
10 6V1B Kd = 37 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
11 6V0X Kd = 277 uM B49 C22 H27 F N4 O2 CCN(CC)CCN....
12 4XY8 Kd = 397 nM 43U C12 H10 Br N5 O COc1ccc(cc....
13 5IGM Kd = 41.7 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
14 4Z6H Kd = 612 nM 4L2 C16 H18 N2 O2 CC1=CC(=O)....
15 6HM0 Kd = 73 nM GBW C50 H64 N8 O9 S Cc1c(scn1)....
16 5F1H Kd = 14.1 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
17 5F1L ic50 = 21 nM 5U2 C19 H24 N2 O4 CC1=CC(=CN....
18 5F25 Kd = 9.1 uM 5TU C14 H14 N2 O2 CC1=CC(=CN....
19 4Z6I - 4L3 C27 H31 N3 O4 CC1=CC(=O)....
20 6V0S Kd = 16000 nM EAE C13 H15 N O2 S CCN1c2cc(c....
21 5EU1 Kd = 15.4 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
22 6V14 Kd = 82 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
23 5F2P Kd = 37.5 uM 5TY C10 H12 N4 O CN1C=Cc2c(....
24 5E3D Kd = 95 uM 5JL C5 H4 N4 O S2 C12=C(NC(=....
25 5C87 - 4YS C9 H7 N O c1ccc2c(c1....
26 5O4T - 9KT C10 H10 N2 O2 CN1c2ccccc....
27 5OV8 Kd = 18 uM AXN C24 H30 N4 O4 S CC(C)Cc1cc....
28 5O4S ic50 = 3.4 uM 9KW C24 H28 N4 O5 S CN1c2cc(c(....
29 5MWH Kd = 1.8 uM UWX C24 H30 N4 O5 S CC(C)Cc1cc....
30 5DY7 - 5GT C9 H7 F3 N2 O c1cc2c(cc1....
31 5T4V ic50 = 60 nM N48 C19 H17 N3 O4 S CC1=CC(=O)....
32 5DYC - 5GU C8 H7 Br N2 O c1cc2c(cc1....
33 5O55 - 9L5 C19 H23 N5 O2 CCN1c2ccc(....
34 5EQ1 Kd = 21 uM BEA C9 H8 N3 S Cc1cccc2c1....
35 5G4S ic50 = 1 uM 8VI C24 H31 N5 O3 CCN(c1cc2c....
36 5EWC - 5SJ C12 H14 N2 O3 CCOC(=O)c1....
37 5EPR Kd = 91 uM 5QY C9 H10 N2 O C[C@H]1C(=....
38 5EVA - 5S9 C11 H9 F2 N3 O Cn1c(ccn1)....
39 5ETD - 5RN C10 H9 N O CC(=O)c1c[....
40 5DYA - 5GV C11 H12 N2 O3 CC[C@@H]1C....
41 5EV9 - 5SB C14 H12 N4 O CC(=O)Nc1c....
42 5MYG Kd = 31 nM LS8 C19 H17 N3 O4 S CC1=Cc2cc(....
43 5MWZ Kd = 7.1 uM KGU C24 H36 N6 O3 CCN1c2cc(c....
44 5G4R ic50 = 7.943 nM LF1 C22 H27 N5 O3 C[C@@H]1CN....
45 5OWA Kd = 3.5 uM B0H C17 H24 N4 O2 S Cc1c(oc(n1....
46 5EM3 - 5Q0 C9 H7 N O c1cc2c(ccc....
47 5ETB Kd = 29 uM 5RO C11 H11 N O Cc1cccc2c1....
48 4UYE Kd = 9.54 nM 9F9 C22 H26 N4 O3 CN1c2cc(c(....
49 5O5F - 9LT C22 H20 F N5 O3 CCN1c2ccc(....
50 5O5A - 9LN C22 H21 N5 O3 CCN1c2ccc(....
51 5O5H - 9LK C17 H14 Cl N3 O3 Cc1c(oc(n1....
52 5C7N Kd = 0.27 uM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
53 5EPS Kd = 38 uM 5QX C9 H10 N2 O CN1c2ccccc....
54 5MWG ic50 = 1.7 uM WGX C25 H30 N4 O4 S CN1c2cc(c(....
55 5D7X Kd = 15 uM XZ8 C14 H13 N3 O2 CC1=C(C(=O....
56 6EKQ Kd = 10.9 uM B0H C17 H24 N4 O2 S Cc1c(oc(n1....
57 6V1E Kd = 121 nM 5SW C20 H23 N3 O3 CN1C=C(c2c....
58 6V17 Kd = 148 nM H1B C22 H22 F3 N3 O3 S2 CCN1C=C(c2....
59 6V0Q Kd = 4200 nM EAE C13 H15 N O2 S CCN1c2cc(c....
60 6V1H Kd = 114 nM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
61 6V16 Kd = 556 nM QMG C20 H19 N3 O2 Cc1ccc(cc1....
62 6V1F Kd = 418 nM 5U6 C20 H23 N3 O3 CN1C=C(c2c....
63 3RCW - MB3 C5 H9 N O CN1CCCC1=O
64 5N49 ic50 = 450 nM 8LW C22 H17 N3 O3 Cc1cc2c(cc....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 4L2; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 4L2 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 4L2; Similar ligands found: 453
No: Ligand Similarity coefficient
1 AJ4 0.9589
2 CC6 0.9441
3 57D 0.9407
4 Q11 0.9388
5 X8E 0.9385
6 L3L 0.9379
7 NAR 0.9366
8 AGI 0.9342
9 B4L 0.9335
10 3WL 0.9328
11 2QV 0.9327
12 LU2 0.9325
13 3JC 0.9317
14 2QU 0.9307
15 O9T 0.9276
16 E6Q 0.9271
17 OUA 0.9271
18 NU3 0.9257
19 MRI 0.9251
20 AJ6 0.9242
21 KMP 0.9241
22 NPZ 0.9234
23 5NN 0.9234
24 O9Z 0.9232
25 CWE 0.9228
26 QUE 0.9214
27 3GX 0.9213
28 OUG 0.9201
29 CUH 0.9198
30 LVY 0.9192
31 6JO 0.9187
32 3WJ 0.9185
33 O9Q 0.9185
34 6JM 0.9184
35 W8L 0.9182
36 E9L 0.9179
37 CDJ 0.9176
38 6ZW 0.9173
39 5WT 0.9163
40 EMU 0.9158
41 KXN 0.9156
42 KTM 0.9151
43 JOH 0.9144
44 PIQ 0.9143
45 KWB 0.9143
46 6BK 0.9139
47 AP6 0.9134
48 7L4 0.9133
49 H2W 0.9133
50 3CA 0.9132
51 VT3 0.9130
52 RGK 0.9129
53 DX7 0.9123
54 M3W 0.9122
55 6QT 0.9117
56 7EH 0.9116
57 XYP XIM 0.9115
58 DFL 0.9112
59 ZRL 0.9105
60 20D 0.9100
61 9CE 0.9095
62 0DF 0.9092
63 SZ5 0.9086
64 NKI 0.9085
65 3F4 0.9082
66 XYP XYP 0.9081
67 47V 0.9077
68 CMG 0.9075
69 1FL 0.9073
70 5E5 0.9072
71 BZC 0.9069
72 F40 0.9066
73 7ZO 0.9059
74 WCU 0.9058
75 7VF 0.9058
76 YEX 0.9048
77 H7S 0.9043
78 6DQ 0.9043
79 25F 0.9043
80 WLH 0.9042
81 1V1 0.9039
82 27M 0.9036
83 NW1 0.9035
84 DDC 0.9035
85 WG8 0.9033
86 NAB 0.9032
87 A73 0.9031
88 2FA 0.9028
89 1R5 0.9028
90 BJ4 0.9027
91 SAK 0.9025
92 272 0.9020
93 VXM 0.9019
94 1V4 0.9015
95 P4L 0.9015
96 TQ1 0.9011
97 NYJ 0.9011
98 XDN XYP 0.9008
99 4RV 0.9008
100 6B5 0.9008
101 DQH 0.9007
102 LI4 0.9006
103 T5J 0.9005
104 XYP XYS 0.8999
105 IRH 0.8998
106 1HP 0.8997
107 ZRK 0.8997
108 DX2 0.8997
109 HWB 0.8995
110 QC1 0.8990
111 40N 0.8988
112 HH6 0.8982
113 XIF XYP 0.8980
114 4GU 0.8978
115 QUG 0.8978
116 15Q 0.8977
117 OSY 0.8976
118 FHI 0.8975
119 697 0.8975
120 1V3 0.8974
121 MYC 0.8972
122 FY8 0.8972
123 IDZ 0.8969
124 4K2 0.8969
125 J8D 0.8969
126 JO5 0.8968
127 LI7 0.8967
128 B2L 0.8966
129 5B2 0.8965
130 DE7 0.8965
131 Y70 0.8963
132 AX1 0.8963
133 FCW 0.8962
134 XYS XYS 0.8960
135 CC5 0.8959
136 LIG 0.8958
137 EV2 0.8957
138 KTV 0.8953
139 0X2 0.8953
140 7LU 0.8953
141 5AD 0.8952
142 0OK 0.8951
143 Q0K 0.8943
144 OA4 0.8942
145 3QI 0.8941
146 AUG 0.8941
147 XDL XYP 0.8940
148 AUE 0.8939
149 0SY 0.8939
150 HBI 0.8935
151 XYP XDN 0.8933
152 BHF 0.8933
153 H32 0.8932
154 DH2 0.8932
155 338 0.8929
156 X0T 0.8928
157 BIE 0.8927
158 78P 0.8927
159 HA6 0.8927
160 4CN 0.8923
161 XIL 0.8922
162 DBE 0.8921
163 NEU 0.8916
164 XYP XIF 0.8916
165 D64 0.8915
166 ZW2 0.8915
167 A63 0.8914
168 DFV 0.8912
169 C4E 0.8912
170 ADN 0.8910
171 4YE 0.8909
172 9JT 0.8908
173 5WS 0.8907
174 BBY 0.8906
175 FSE 0.8905
176 5P3 0.8905
177 JOB 0.8901
178 38E 0.8900
179 PFT 0.8899
180 LWS 0.8895
181 6EN 0.8894
182 IDD 0.8892
183 1Q4 0.8891
184 BXZ 0.8889
185 6TJ 0.8888
186 5WK 0.8885
187 AUY 0.8884
188 3D8 0.8883
189 NIF 0.8882
190 OT4 0.8882
191 TCW 0.8881
192 YE6 0.8876
193 MHB 0.8874
194 ZEA 0.8874
195 Q5M 0.8872
196 DXK 0.8867
197 2GQ 0.8867
198 BUX 0.8866
199 4NR 0.8865
200 0UL 0.8864
201 SA0 0.8863
202 5WW 0.8860
203 DZ1 0.8858
204 CUT 0.8857
205 4RG 0.8856
206 CFK 0.8856
207 4F8 0.8855
208 TCT 0.8851
209 H35 0.8849
210 IQW 0.8847
211 MYU 0.8846
212 2L2 0.8845
213 GMP 0.8844
214 LJ4 0.8843
215 NIY 0.8842
216 TOP 0.8840
217 B2E 0.8840
218 VXP 0.8837
219 BL7 0.8836
220 2JX 0.8835
221 XTS 0.8833
222 DBS 0.8832
223 CHV 0.8830
224 YE7 0.8828
225 91F 0.8826
226 KUP 0.8825
227 ARJ 0.8823
228 NOC 0.8823
229 LVE 0.8822
230 HFT 0.8822
231 3TI 0.8819
232 3L1 0.8818
233 CJZ 0.8816
234 1UZ 0.8815
235 EF2 0.8815
236 AVX 0.8815
237 6DE 0.8815
238 KLV 0.8815
239 LR2 0.8815
240 MUX 0.8812
241 LZJ 0.8811
242 TYP 0.8809
243 AD3 0.8809
244 BIO 0.8808
245 833 0.8808
246 1V8 0.8807
247 TRP 0.8806
248 P2L 0.8805
249 UX0 0.8805
250 FNT 0.8804
251 3IP 0.8803
252 7A9 0.8802
253 6XC 0.8800
254 U13 0.8800
255 47X 0.8799
256 FL8 0.8799
257 KF5 0.8798
258 ZSP 0.8798
259 UN4 0.8797
260 SGW 0.8796
261 CBE 0.8795
262 3D1 0.8795
263 QS4 0.8789
264 8OB 0.8788
265 8OE 0.8787
266 XYS XYP 0.8787
267 4YF 0.8786
268 XYS AZI XYS 0.8786
269 5V7 0.8786
270 6JP 0.8785
271 JVD 0.8779
272 ELH 0.8778
273 DSQ 0.8778
274 M16 0.8778
275 7XX 0.8777
276 6WL 0.8775
277 5XL 0.8774
278 53X 0.8773
279 96Z 0.8773
280 J8G 0.8773
281 XDH 0.8772
282 92O 0.8770
283 LJ5 0.8769
284 5F1 0.8767
285 DCN 0.8767
286 5ZM 0.8764
287 F4U 0.8762
288 ID8 0.8762
289 LP8 0.8760
290 4AU 0.8757
291 TCC 0.8756
292 FX5 0.8756
293 KP2 0.8755
294 244 0.8755
295 FHV 0.8755
296 ISX 0.8754
297 BHS 0.8754
298 JO8 0.8749
299 51Y 0.8748
300 U14 0.8747
301 GNG 0.8747
302 CHJ 0.8746
303 2L1 0.8740
304 IMK 0.8740
305 FYR 0.8740
306 5I5 0.8738
307 2P3 0.8737
308 X29 0.8737
309 5M2 0.8736
310 PNJ 0.8734
311 KOM 0.8732
312 6J3 0.8732
313 AVA 0.8731
314 TCL 0.8729
315 5ER 0.8727
316 NAL 0.8727
317 108 0.8726
318 BNY 0.8726
319 5CD 0.8726
320 MGI 0.8723
321 4ZF 0.8722
322 Q8D 0.8722
323 EES 0.8722
324 15I 0.8721
325 5FD 0.8718
326 4G2 0.8717
327 MHD GAL 0.8716
328 LMZ 0.8713
329 DS8 0.8711
330 4FF 0.8710
331 CHQ 0.8709
332 TLF 0.8708
333 5XK 0.8708
334 69K 0.8708
335 4AB 0.8706
336 DMB 0.8705
337 3WK 0.8705
338 LL1 0.8703
339 PD6 0.8703
340 5S9 0.8700
341 Q8G 0.8694
342 CMP 0.8693
343 1SF 0.8692
344 SNJ 0.8691
345 H2B 0.8691
346 8UY 0.8691
347 IMH 0.8690
348 JF8 0.8689
349 22T 0.8688
350 CUQ 0.8688
351 KYN 0.8687
352 B2X 0.8685
353 BL4 0.8685
354 Q9T 0.8685
355 0MB 0.8683
356 IK1 0.8682
357 6EL 0.8682
358 PV1 0.8682
359 LOX XYP 0.8680
360 SIJ 0.8680
361 P4T 0.8677
362 U12 0.8676
363 PNW 0.8676
364 5F7 0.8673
365 8KW 0.8670
366 3DE 0.8670
367 5E4 0.8669
368 789 0.8669
369 XDI 0.8666
370 C4F 0.8665
371 YUG 0.8665
372 4YC 0.8665
373 5R9 0.8661
374 MTA 0.8658
375 1ER 0.8652
376 PNX 0.8649
377 HUL 0.8647
378 555 0.8646
379 A0R 0.8646
380 3UG 0.8646
381 H75 0.8646
382 28A 0.8645
383 AUV 0.8644
384 BHM 0.8644
385 1QV 0.8643
386 9K2 0.8643
387 NOS 0.8643
388 F18 0.8642
389 56N 0.8641
390 BRY 0.8640
391 M77 0.8638
392 5E1 0.8632
393 FT6 0.8630
394 IQP 0.8628
395 553 0.8628
396 P9I 0.8628
397 MEX 0.8627
398 MQR 0.8619
399 5C1 0.8619
400 8E3 0.8618
401 WA2 0.8616
402 T98 0.8615
403 FM2 0.8614
404 JCZ 0.8614
405 LRT 0.8613
406 WVV 0.8612
407 EZB 0.8610
408 FB4 0.8610
409 3AK 0.8609
410 PCG 0.8607
411 NTF 0.8605
412 4Z9 0.8604
413 5VU 0.8601
414 NQ7 0.8600
415 KS5 0.8599
416 5DN 0.8598
417 H52 0.8594
418 J47 0.8594
419 38B 0.8590
420 8WB 0.8589
421 D25 0.8587
422 0NJ 0.8584
423 MG7 0.8584
424 IFM BMA 0.8583
425 SU9 0.8582
426 41L 0.8579
427 3D3 0.8577
428 G2V 0.8572
429 26A 0.8572
430 CL9 0.8570
431 J38 0.8569
432 2D2 0.8568
433 GVI 0.8566
434 2UD 0.8566
435 GAT 0.8560
436 MIL 0.8557
437 3RP 0.8556
438 JFS 0.8554
439 WL3 0.8550
440 YK9 0.8546
441 A9B 0.8545
442 YIP 0.8544
443 9MR 0.8543
444 Q12 0.8541
445 5YA 0.8540
446 J84 0.8539
447 3AD 0.8535
448 7G1 0.8532
449 6SY 0.8532
450 22L 0.8527
451 IMV 0.8525
452 5DE 0.8514
453 I0D 0.8514
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5F1H; Ligand: 5U6; Similar sites found with APoc: 4
This union binding pocket(no: 1) in the query (biounit: 5f1h.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
1 6J3P B8O 34.9594
2 6J3O B4L 35
3 6J3O B4L 35
4 5TPX 7H7 35.7724
Pocket No.: 2; Query (leader) PDB : 5F1H; Ligand: 5U6; Similar sites found with APoc: 9
This union binding pocket(no: 2) in the query (biounit: 5f1h.bio2) has 19 residues
No: Leader PDB Ligand Sequence Similarity
1 6J3P B8O 34.9594
2 6J3P B8O 34.9594
3 6J3O B4L 35
4 5TPX 7H7 35.7724
5 5MLJ 9ST 38.3929
6 5MLJ 9ST 38.3929
7 5ML0 P2L 39.0909
8 5FDZ 5X0 41.1765
9 5FDZ 5X0 41.1765
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