Receptor
PDB id Resolution Class Description Source Keywords
5aol 1.5 Å NON-ENZYME: BINDING STRUCTURE OF THE P53 CANCER MUTANT Y220C WITH BOUND 3-BROMO- (TRIFLUOROMETHYL)BENZENE-1,2-DIAMINE HOMO SAPIENS CELL CYCLE P53 CANCER TUMOR SUPPRESSION DNA BINDING CANTHERAPY SMALL-MOLECULE STABILIZERS MOLECULAR CHAPERONE
Ref.: EXPLOITING TRANSIENT PROTEIN STATES FOR THE DESIGN SMALL-MOLECULE STABILIZERS OF MUTANT P53. STRUCTURE V. 23 2246 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ZN A:1300;
B:1300;
 Part of Protein;
Part of Protein;
 none;
none;
 submit data
65.409 Zn [Zn+2...
UFV A:1293;
 Valid;
 none;
 Kd = 4800 uM
255.035 C7 H6 Br F3 N2 c1c(c...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6SI3 1.4 Å NON-ENZYME: BINDING P53 CANCER MUTANT Y220S IN COMPLEX WITH SMALL-MOLECULE STABI PK9301 HOMO SAPIENS P53 TRANSCRIPTION FACTOR TUMOR SUPPRESSOR CANCER THERAPYONCOGENIC MUTANT PROTEIN MISFOLDING DNA-BINDING DOMAIN DSURFACE CREVICE SMALL-MOLECULE STABILIZER MUTANT P53 RESCBINDING PROTEIN
Ref.: TARGETING CAVITY-CREATING P53 CANCER MUTATIONS WITH SMALL-MOLECULE STABILIZERS: THE Y220X PARADIGM. ACS CHEM.BIOL. V. 15 657 2020
Members (40)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 552 families.
1 2X0W - X0W C10 H11 N O2 S Cc1nc2cc(c....
2 4AGM Kd = 105 uM P86 C16 H24 I2 N2 O CCN(CC)C1C....
3 5AB9 Kd = 470 uM 92O C15 H20 N2 CCc1cccc2c....
4 6GGE - EYE C21 H23 N2 S CCn1c2ccc(....
5 2X0V - X0V C7 H7 F3 N2 c1cc(c(cc1....
6 5O1A Kd = 30 uM 9H5 C16 H17 I2 N3 O2 CN1CCN(CC1....
7 5G4O Kd = 37.2 uM O80 C17 H17 F3 N2 CN(C)Cc1cc....
8 5O1F Kd = 30 uM 9GQ C15 H16 I N O4 CCCCOc1cc(....
9 5AOJ Kd = 21 uM Y0V C11 H7 I2 N O3 c1ccn(c1)c....
10 6GGF - EXQ C21 H23 N2 S CCn1c2ccc(....
11 5O1G Kd = 116 uM 9GK C19 H16 I N O4 c1ccc(cc1)....
12 5O1I Kd = 4 uM 9GH C16 H16 I N3 O3 S CCN(CC)c1n....
13 5AOL Kd = 4800 uM UFV C7 H6 Br F3 N2 c1c(cc(c(c....
14 6GGC - EXN C20 H21 N2 O CCn1c2ccc(....
15 5AOI Kd = 940 uM RZH C13 H17 Br N2 CCc1cc(cc2....
16 5O1D Kd = 22 uM 9GW C14 H14 I N O4 CCCOc1cc(c....
17 4AGP Kd = 20.6 uM P51 C25 H31 I N2 O2 CCN(CC)C1C....
18 6SI4 Kd = 5.9 uM LEK C19 H19 N3 S CCn1c2ccc(....
19 3ZME - QC5 C17 H19 F N4 CN(C)CCn1c....
20 5AOK - GOH C11 H10 N6 O c1ccn(c1)c....
21 6SI3 Kd = 4 uM LEB C16 H14 Br F3 N2 CNCc1ccc2c....
22 5A7B Kd = 271 uM KMN C27 H32 N2 O2 CCN(CC)C1C....
23 5ABA Kd = 1040 uM UL7 C17 H24 Br Cl N2 O2 c1c(cc(c(c....
24 6GGD - EYB C19 H20 N3 O CCn1c2ccc(....
25 2VUK Kd = 125 uM P83 C16 H18 N2 CCn1c2cccc....
26 4AGQ Kd = 9.7 uM P96 C25 H32 I N3 O CCN(CC)C1C....
27 5O1E Kd = 33 uM 9GT C14 H12 I N O4 C=CCOc1cc(....
28 4AGN Kd = 107 uM NXG C19 H27 I N2 O2 CCN(CC)C1C....
29 6GGA - EY2 C16 H18 Br N2 CCn1c2ccc(....
30 5O1B Kd = 20 uM 9H2 C11 H9 I2 N O2 c1ccn(c1)c....
31 5AOM Kd = 1270 uM FY8 C12 H15 Cl N2 O2 c1cc(c(cc1....
32 2X0U - X0U C9 H8 N2 O2 S c1c2c(cc3c....
33 4AGO Kd = 15.5 uM P74 C24 H36 I N3 O3 CCN(CC)C1C....
34 5O1C Kd = 113 uM 9GZ C17 H11 F I N O3 c1ccn(c1)c....
35 5G4N Kd = 101 uM O83 C16 H16 F2 N2 CNCc1ccc2c....
36 6GGB - EXQ C21 H23 N2 S CCn1c2ccc(....
37 5O1H Kd = 14 uM 9GN C14 H14 I N O3 S CCCSc1cc(c....
38 4AGL Kd = 225 uM P84 C14 H20 I2 N2 O CN1CCC(CC1....
39 6SI0 Kd = 5.3 uM LEK C19 H19 N3 S CCn1c2ccc(....
40 5G4M Kd = 138 uM O82 C16 H17 F N2 CNCc1ccc2c....
70% Homology Family (40)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 426 families.
1 2X0W - X0W C10 H11 N O2 S Cc1nc2cc(c....
2 4AGM Kd = 105 uM P86 C16 H24 I2 N2 O CCN(CC)C1C....
3 5AB9 Kd = 470 uM 92O C15 H20 N2 CCc1cccc2c....
4 6GGE - EYE C21 H23 N2 S CCn1c2ccc(....
5 2X0V - X0V C7 H7 F3 N2 c1cc(c(cc1....
6 5O1A Kd = 30 uM 9H5 C16 H17 I2 N3 O2 CN1CCN(CC1....
7 5G4O Kd = 37.2 uM O80 C17 H17 F3 N2 CN(C)Cc1cc....
8 5O1F Kd = 30 uM 9GQ C15 H16 I N O4 CCCCOc1cc(....
9 5AOJ Kd = 21 uM Y0V C11 H7 I2 N O3 c1ccn(c1)c....
10 6GGF - EXQ C21 H23 N2 S CCn1c2ccc(....
11 5O1G Kd = 116 uM 9GK C19 H16 I N O4 c1ccc(cc1)....
12 5O1I Kd = 4 uM 9GH C16 H16 I N3 O3 S CCN(CC)c1n....
13 5AOL Kd = 4800 uM UFV C7 H6 Br F3 N2 c1c(cc(c(c....
14 6GGC - EXN C20 H21 N2 O CCn1c2ccc(....
15 5AOI Kd = 940 uM RZH C13 H17 Br N2 CCc1cc(cc2....
16 5O1D Kd = 22 uM 9GW C14 H14 I N O4 CCCOc1cc(c....
17 4AGP Kd = 20.6 uM P51 C25 H31 I N2 O2 CCN(CC)C1C....
18 6SI4 Kd = 5.9 uM LEK C19 H19 N3 S CCn1c2ccc(....
19 3ZME - QC5 C17 H19 F N4 CN(C)CCn1c....
20 5AOK - GOH C11 H10 N6 O c1ccn(c1)c....
21 6SI3 Kd = 4 uM LEB C16 H14 Br F3 N2 CNCc1ccc2c....
22 5A7B Kd = 271 uM KMN C27 H32 N2 O2 CCN(CC)C1C....
23 5ABA Kd = 1040 uM UL7 C17 H24 Br Cl N2 O2 c1c(cc(c(c....
24 6GGD - EYB C19 H20 N3 O CCn1c2ccc(....
25 2VUK Kd = 125 uM P83 C16 H18 N2 CCn1c2cccc....
26 4AGQ Kd = 9.7 uM P96 C25 H32 I N3 O CCN(CC)C1C....
27 5O1E Kd = 33 uM 9GT C14 H12 I N O4 C=CCOc1cc(....
28 4AGN Kd = 107 uM NXG C19 H27 I N2 O2 CCN(CC)C1C....
29 6GGA - EY2 C16 H18 Br N2 CCn1c2ccc(....
30 5O1B Kd = 20 uM 9H2 C11 H9 I2 N O2 c1ccn(c1)c....
31 5AOM Kd = 1270 uM FY8 C12 H15 Cl N2 O2 c1cc(c(cc1....
32 2X0U - X0U C9 H8 N2 O2 S c1c2c(cc3c....
33 4AGO Kd = 15.5 uM P74 C24 H36 I N3 O3 CCN(CC)C1C....
34 5O1C Kd = 113 uM 9GZ C17 H11 F I N O3 c1ccn(c1)c....
35 5G4N Kd = 101 uM O83 C16 H16 F2 N2 CNCc1ccc2c....
36 6GGB - EXQ C21 H23 N2 S CCn1c2ccc(....
37 5O1H Kd = 14 uM 9GN C14 H14 I N O3 S CCCSc1cc(c....
38 4AGL Kd = 225 uM P84 C14 H20 I2 N2 O CN1CCC(CC1....
39 6SI0 Kd = 5.3 uM LEK C19 H19 N3 S CCn1c2ccc(....
40 5G4M Kd = 138 uM O82 C16 H17 F N2 CNCc1ccc2c....
50% Homology Family (40)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 322 families.
1 2X0W - X0W C10 H11 N O2 S Cc1nc2cc(c....
2 4AGM Kd = 105 uM P86 C16 H24 I2 N2 O CCN(CC)C1C....
3 5AB9 Kd = 470 uM 92O C15 H20 N2 CCc1cccc2c....
4 6GGE - EYE C21 H23 N2 S CCn1c2ccc(....
5 2X0V - X0V C7 H7 F3 N2 c1cc(c(cc1....
6 5O1A Kd = 30 uM 9H5 C16 H17 I2 N3 O2 CN1CCN(CC1....
7 5G4O Kd = 37.2 uM O80 C17 H17 F3 N2 CN(C)Cc1cc....
8 5O1F Kd = 30 uM 9GQ C15 H16 I N O4 CCCCOc1cc(....
9 5AOJ Kd = 21 uM Y0V C11 H7 I2 N O3 c1ccn(c1)c....
10 6GGF - EXQ C21 H23 N2 S CCn1c2ccc(....
11 5O1G Kd = 116 uM 9GK C19 H16 I N O4 c1ccc(cc1)....
12 5O1I Kd = 4 uM 9GH C16 H16 I N3 O3 S CCN(CC)c1n....
13 5AOL Kd = 4800 uM UFV C7 H6 Br F3 N2 c1c(cc(c(c....
14 6GGC - EXN C20 H21 N2 O CCn1c2ccc(....
15 5AOI Kd = 940 uM RZH C13 H17 Br N2 CCc1cc(cc2....
16 5O1D Kd = 22 uM 9GW C14 H14 I N O4 CCCOc1cc(c....
17 4AGP Kd = 20.6 uM P51 C25 H31 I N2 O2 CCN(CC)C1C....
18 6SI4 Kd = 5.9 uM LEK C19 H19 N3 S CCn1c2ccc(....
19 3ZME - QC5 C17 H19 F N4 CN(C)CCn1c....
20 5AOK - GOH C11 H10 N6 O c1ccn(c1)c....
21 6SI3 Kd = 4 uM LEB C16 H14 Br F3 N2 CNCc1ccc2c....
22 5A7B Kd = 271 uM KMN C27 H32 N2 O2 CCN(CC)C1C....
23 5ABA Kd = 1040 uM UL7 C17 H24 Br Cl N2 O2 c1c(cc(c(c....
24 6GGD - EYB C19 H20 N3 O CCn1c2ccc(....
25 2VUK Kd = 125 uM P83 C16 H18 N2 CCn1c2cccc....
26 4AGQ Kd = 9.7 uM P96 C25 H32 I N3 O CCN(CC)C1C....
27 5O1E Kd = 33 uM 9GT C14 H12 I N O4 C=CCOc1cc(....
28 4AGN Kd = 107 uM NXG C19 H27 I N2 O2 CCN(CC)C1C....
29 6GGA - EY2 C16 H18 Br N2 CCn1c2ccc(....
30 5O1B Kd = 20 uM 9H2 C11 H9 I2 N O2 c1ccn(c1)c....
31 5AOM Kd = 1270 uM FY8 C12 H15 Cl N2 O2 c1cc(c(cc1....
32 2X0U - X0U C9 H8 N2 O2 S c1c2c(cc3c....
33 4AGO Kd = 15.5 uM P74 C24 H36 I N3 O3 CCN(CC)C1C....
34 5O1C Kd = 113 uM 9GZ C17 H11 F I N O3 c1ccn(c1)c....
35 5G4N Kd = 101 uM O83 C16 H16 F2 N2 CNCc1ccc2c....
36 6GGB - EXQ C21 H23 N2 S CCn1c2ccc(....
37 5O1H Kd = 14 uM 9GN C14 H14 I N O3 S CCCSc1cc(c....
38 4AGL Kd = 225 uM P84 C14 H20 I2 N2 O CN1CCC(CC1....
39 6SI0 Kd = 5.3 uM LEK C19 H19 N3 S CCn1c2ccc(....
40 5G4M Kd = 138 uM O82 C16 H17 F N2 CNCc1ccc2c....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: UFV; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 UFV 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: UFV; Similar ligands found: 986
No: Ligand Similarity coefficient
1 DHK 0.9743
2 4XV 0.9701
3 X0V 0.9691
4 A13 0.9671
5 FGZ 0.9664
6 QSH 0.9653
7 IFP 0.9651
8 4XS 0.9646
9 EKZ 0.9640
10 GDE 0.9629
11 4FH 0.9623
12 4SX 0.9599
13 MJ2 0.9582
14 6OT 0.9572
15 FBU 0.9559
16 BDP 0.9558
17 BGC 0.9496
18 7WR 0.9495
19 GTR 0.9472
20 FA3 0.9451
21 DQA 0.9433
22 SKM 0.9415
23 ORO 0.9406
24 51R 0.9403
25 IHB 0.9397
26 15L 0.9394
27 SAN 0.9391
28 EXD 0.9389
29 DHB 0.9388
30 QSB 0.9388
31 D1X 0.9384
32 EVA 0.9383
33 P9P 0.9379
34 KGK 0.9378
35 INO 0.9375
36 MYJ 0.9374
37 XXG 0.9372
38 CHB 0.9371
39 93K 0.9370
40 4A3 0.9365
41 GCU 0.9362
42 4NC 0.9362
43 FHB 0.9361
44 GCB 0.9354
45 L7T 0.9347
46 NNO 0.9346
47 DOR 0.9334
48 EGR 0.9332
49 TSU 0.9332
50 3HM 0.9329
51 XX2 0.9323
52 FCR 0.9323
53 2HO 0.9322
54 34D 0.9319
55 AW5 0.9317
56 9TW 0.9316
57 XCZ 0.9315
58 P7Y 0.9310
59 FBS 0.9309
60 LNR 0.9307
61 GLC 0.9302
62 OXC 0.9300
63 FA6 0.9292
64 VNL 0.9291
65 FBW 0.9290
66 ADA 0.9284
67 K5W 0.9270
68 23J 0.9264
69 ZXD 0.9256
70 AZ9 0.9255
71 ASC 0.9255
72 F31 0.9253
73 GAL 0.9243
74 3FH 0.9242
75 QIC 0.9236
76 FA1 0.9234
77 R9S 0.9234
78 JKZ 0.9231
79 4J8 0.9231
80 4AA 0.9230
81 J9Q 0.9230
82 HQT 0.9229
83 3MG 0.9228
84 GCS 0.9227
85 KFH 0.9227
86 2FG 0.9224
87 HQD 0.9223
88 DS0 0.9217
89 8WO 0.9216
90 TTL 0.9215
91 DHS 0.9214
92 36E 0.9209
93 2HC 0.9204
94 2PG 0.9203
95 SYA 0.9200
96 SVD 0.9199
97 SKA 0.9197
98 3OC 0.9197
99 AMS 0.9196
100 LGC 0.9195
101 EDR 0.9194
102 8S0 0.9193
103 MAJ 0.9192
104 4CS 0.9192
105 ONR 0.9191
106 YIO 0.9188
107 DBX 0.9188
108 JTH 0.9188
109 2O6 0.9183
110 BNT 0.9176
111 39O 0.9176
112 5QX 0.9175
113 L99 0.9175
114 R8V 0.9175
115 CN0 0.9174
116 PRZ 0.9174
117 12Q 0.9174
118 HPS 0.9172
119 0N7 0.9170
120 KTA 0.9162
121 G3F 0.9161
122 1GN 0.9161
123 XSP 0.9160
124 KJH 0.9160
125 KBG 0.9158
126 HQJ 0.9157
127 AAS 0.9153
128 EYK 0.9152
129 2AL 0.9149
130 PHB 0.9145
131 4Z4 0.9142
132 FOT 0.9140
133 QPR 0.9139
134 CBF 0.9137
135 C2U 0.9137
136 7W1 0.9137
137 HJP 0.9137
138 1F1 0.9136
139 N3W 0.9132
140 NGO 0.9132
141 ESI 0.9130
142 DNC 0.9130
143 9PY 0.9129
144 0F9 0.9126
145 0HO 0.9121
146 E7Z 0.9121
147 GIV 0.9120
148 97T 0.9118
149 3NY 0.9117
150 IJZ 0.9117
151 DIN 0.9115
152 LT2 0.9115
153 0HN 0.9114
154 3AL 0.9114
155 KYA 0.9108
156 DA4 0.9105
157 VXX 0.9105
158 52C 0.9103
159 A7W 0.9102
160 DHY 0.9099
161 0W1 0.9098
162 Z5P 0.9098
163 149 0.9098
164 APZ 0.9096
165 6XI 0.9096
166 SYR 0.9095
167 HBD 0.9095
168 HKD 0.9094
169 2ZM 0.9086
170 1Y6 0.9085
171 OMD 0.9085
172 AMQ 0.9084
173 5NI 0.9083
174 60Q 0.9083
175 NMJ 0.9083
176 2H5 0.9081
177 ASO 0.9081
178 NPO 0.9079
179 3HB 0.9079
180 GAB 0.9078
181 6NT 0.9077
182 L5V 0.9077
183 TWO 0.9074
184 M4S 0.9074
185 BEA 0.9074
186 6DP 0.9073
187 RAT 0.9072
188 UNC 0.9072
189 LDP 0.9069
190 FB2 0.9068
191 KT7 0.9065
192 OW4 0.9061
193 3MB 0.9060
194 EMZ 0.9059
195 GLA 0.9059
196 5NS 0.9059
197 DIU 0.9058
198 92K 0.9056
199 PAB 0.9054
200 7N0 0.9053
201 4P5 0.9052
202 OVM 0.9052
203 OTR 0.9050
204 OVV 0.9050
205 3NT 0.9049
206 3ID 0.9048
207 QY9 0.9047
208 SWA 0.9043
209 WCE 0.9043
210 G4D 0.9038
211 AS3 0.9038
212 NDH 0.9037
213 FBV 0.9037
214 CTS 0.9035
215 JR2 0.9035
216 ABI 0.9034
217 PMB 0.9033
218 KUF 0.9033
219 5HN 0.9032
220 HA5 0.9031
221 RHU 0.9028
222 SEP 0.9027
223 IV2 0.9027
224 86J 0.9027
225 6NI 0.9026
226 GYE 0.9026
227 Q6T 0.9026
228 BRT 0.9025
229 F69 0.9024
230 HDH 0.9023
231 K3Q 0.9023
232 HHA 0.9020
233 8W9 0.9019
234 H7Y 0.9019
235 9FE 0.9018
236 Q88 0.9018
237 3IT 0.9017
238 3BZ 0.9014
239 2FQ 0.9014
240 P72 0.9014
241 AJ2 0.9014
242 3HA 0.9013
243 NBG 0.9013
244 2HU 0.9011
245 FB1 0.9011
246 LAO 0.9010
247 P84 0.9010
248 QMP 0.9010
249 EA1 0.9010
250 3AB 0.9009
251 AY4 0.9009
252 ICO 0.9007
253 URC 0.9007
254 ES0 0.9006
255 E35 0.9005
256 DMD 0.9002
257 EV0 0.9001
258 RMN 0.9000
259 4JC 0.8999
260 TOF 0.8998
261 KOJ 0.8998
262 3M0 0.8997
263 B85 0.8996
264 4MA 0.8995
265 DBH 0.8995
266 LZ2 0.8994
267 CWM 0.8993
268 XQK 0.8993
269 NVU 0.8993
270 57O 0.8992
271 HIS 0.8990
272 4HC 0.8990
273 4MU 0.8988
274 IOS 0.8987
275 AC6 0.8987
276 2D0 0.8987
277 EDM 0.8986
278 TSR 0.8985
279 2A9 0.8985
280 M5K 0.8985
281 1XA 0.8985
282 ROI 0.8985
283 67N 0.8984
284 2CZ 0.8984
285 8OZ 0.8984
286 SHG 0.8984
287 GZL 0.8984
288 4ME 0.8983
289 0P6 0.8982
290 069 0.8982
291 42J 0.8980
292 PBZ 0.8980
293 OVP 0.8979
294 G1P 0.8979
295 3A9 0.8979
296 NOJ 0.8979
297 5RO 0.8978
298 3PF 0.8978
299 AEH 0.8978
300 3C4 0.8975
301 3SL 0.8975
302 SJ5 0.8974
303 AX3 0.8973
304 MRW 0.8972
305 V55 0.8972
306 KKN 0.8972
307 IFL 0.8971
308 FDK 0.8971
309 AKH 0.8970
310 1P3 0.8969
311 5WV 0.8969
312 5IQ 0.8969
313 MT0 0.8966
314 FE DB1 0.8966
315 495 0.8965
316 2D3 0.8964
317 NOY 0.8964
318 NTZ 0.8963
319 53C 0.8963
320 BZ2 0.8963
321 0JD 0.8961
322 C2Y 0.8961
323 4XR 0.8960
324 4ZA 0.8959
325 XDE 0.8959
326 ALE 0.8959
327 8CM 0.8958
328 S0E 0.8958
329 5SG 0.8957
330 6ME 0.8956
331 24W 0.8955
332 G3E 0.8955
333 ISN 0.8955
334 X05 0.8955
335 H4E 0.8954
336 AZ8 0.8954
337 J9T 0.8954
338 PAC 0.8953
339 CWS 0.8952
340 PE0 0.8952
341 EOL 0.8952
342 IAC 0.8951
343 5JQ 0.8951
344 X09 0.8951
345 MSR 0.8950
346 6FZ 0.8949
347 N5J 0.8948
348 R2P 0.8948
349 1LQ 0.8948
350 Q24 0.8948
351 UFO 0.8948
352 4XH 0.8947
353 RSO 0.8947
354 3F0 0.8946
355 XAZ 0.8946
356 PZI 0.8946
357 4HM 0.8945
358 8U3 0.8945
359 42C 0.8944
360 PHH 0.8943
361 6TZ 0.8943
362 5RN 0.8942
363 ES7 0.8940
364 HX3 0.8936
365 M1Z 0.8936
366 JBK 0.8936
367 HLZ 0.8936
368 1SQ 0.8935
369 826 0.8935
370 45L 0.8934
371 FA0 0.8933
372 I7A 0.8932
373 X6X 0.8931
374 GOX 0.8931
375 293 0.8931
376 15N 0.8931
377 152 0.8930
378 MBG 0.8930
379 E5X 0.8927
380 TZF 0.8927
381 7NI 0.8927
382 HHH 0.8926
383 5WY 0.8926
384 M1A 0.8925
385 1NP 0.8925
386 6M4 0.8924
387 8GC 0.8922
388 EUG 0.8921
389 8XQ 0.8921
390 GV9 0.8921
391 MO8 0.8921
392 4M4 0.8921
393 Z82 0.8921
394 7VS 0.8920
395 2AK 0.8920
396 DEE 0.8920
397 G2F 0.8920
398 DNF 0.8919
399 4WL 0.8918
400 QUS 0.8918
401 7MU 0.8917
402 7W4 0.8917
403 M5H 0.8917
404 JBH 0.8916
405 GAF 0.8915
406 GXL 0.8915
407 1SA 0.8915
408 PIM 0.8914
409 5NE 0.8914
410 UAN 0.8914
411 9KH 0.8914
412 8WT 0.8913
413 M6N 0.8913
414 M1Q 0.8912
415 AQO 0.8912
416 GVG 0.8911
417 R20 0.8911
418 J5I 0.8910
419 SE2 0.8910
420 AIN 0.8910
421 HG3 0.8910
422 1LM 0.8910
423 KBZ 0.8910
424 3PG 0.8910
425 CFF 0.8909
426 2LY 0.8909
427 LDR 0.8909
428 D48 0.8908
429 ICB 0.8908
430 PFB 0.8907
431 HH8 0.8907
432 MPK 0.8907
433 2HQ 0.8907
434 92P 0.8907
435 GWM 0.8906
436 5QY 0.8905
437 I6G 0.8904
438 5Q0 0.8904
439 GTQ 0.8903
440 MEW 0.8903
441 9MG 0.8903
442 4YS 0.8903
443 TAG 0.8903
444 F0J 0.8902
445 44V 0.8899
446 A29 0.8899
447 LYL 0.8899
448 XQI 0.8898
449 ES1 0.8897
450 2A7 0.8897
451 9AP 0.8897
452 JPZ 0.8896
453 PIY 0.8895
454 9RW 0.8895
455 8GK 0.8895
456 HQY 0.8894
457 GF4 0.8894
458 173 0.8894
459 1KP 0.8893
460 ANN 0.8893
461 B2J 0.8892
462 KJ5 0.8890
463 MWP 0.8890
464 MUA 0.8889
465 JRB 0.8888
466 GUN 0.8888
467 O72 0.8888
468 PEP 0.8887
469 DOB 0.8887
470 F12 0.8887
471 JND 0.8886
472 75K 0.8886
473 CPZ 0.8885
474 DX3 0.8885
475 1DV 0.8885
476 3DO 0.8885
477 4KL 0.8884
478 0FK 0.8884
479 61M 0.8883
480 2F6 0.8882
481 9ZE 0.8882
482 174 0.8881
483 0W8 0.8881
484 9FL 0.8880
485 OA3 0.8880
486 1AL 0.8880
487 692 0.8879
488 II6 0.8879
489 5WU 0.8879
490 DGJ 0.8878
491 0FN 0.8878
492 SG2 0.8878
493 A9P 0.8878
494 HZQ 0.8877
495 B62 0.8877
496 S2G 0.8877
497 4M0 0.8876
498 SOR 0.8875
499 4JQ 0.8875
500 FBT 0.8873
501 S76 0.8873
502 SHA 0.8873
503 FK8 0.8873
504 H6B 0.8872
505 CH9 0.8872
506 E4P 0.8871
507 DBJ 0.8871
508 QMS 0.8871
509 NID 0.8870
510 XM0 0.8869
511 IPD 0.8868
512 BHA 0.8866
513 12T 0.8866
514 CXP 0.8865
515 GZ3 0.8865
516 ESP 0.8865
517 AMH 0.8865
518 HDL 0.8864
519 SKF 0.8864
520 J9W 0.8863
521 NQ 0.8862
522 67X 0.8862
523 N8Y 0.8862
524 JFJ 0.8861
525 NIZ 0.8860
526 4HP 0.8860
527 PHU 0.8860
528 XIY 0.8860
529 CFA 0.8859
530 3Z8 0.8859
531 SOE 0.8859
532 D07 0.8857
533 9KT 0.8856
534 A9O 0.8856
535 3HP 0.8856
536 VOH 0.8855
537 7ME 0.8855
538 SNU 0.8855
539 HLD 0.8853
540 VK3 0.8853
541 PEQ 0.8853
542 49O 0.8853
543 S8D 0.8853
544 COU 0.8853
545 SX1 0.8852
546 GRX 0.8852
547 SMN 0.8851
548 GP9 0.8851
549 GJZ 0.8849
550 CFI 0.8849
551 H42 0.8849
552 6RQ 0.8848
553 505 0.8848
554 PXL 0.8847
555 0GZ 0.8847
556 S7J 0.8847
557 5CU 0.8847
558 ODO 0.8847
559 M0W 0.8847
560 5XC 0.8846
561 8NX 0.8845
562 NLA 0.8845
563 5RG 0.8844
564 TTY 0.8844
565 9TZ 0.8843
566 MS9 0.8842
567 JG8 0.8842
568 O2A 0.8842
569 3AE 0.8841
570 1A7 0.8841
571 Q02 0.8841
572 54G 0.8841
573 MR1 0.8840
574 KBB 0.8840
575 EVF 0.8839
576 TPA 0.8839
577 5M0 0.8838
578 HNQ 0.8838
579 M0Q 0.8837
580 LR5 0.8837
581 9DG 0.8837
582 X8D 0.8837
583 4AV 0.8836
584 CTL 0.8836
585 8ZE 0.8836
586 CFP 0.8836
587 A09 0.8835
588 OCH 0.8835
589 1XN 0.8834
590 H5B 0.8834
591 FBF 0.8834
592 DGL 0.8831
593 JDN 0.8831
594 CLZ 0.8831
595 OTW 0.8831
596 5OB 0.8830
597 E1T 0.8830
598 ALL 0.8827
599 2AQ 0.8827
600 RXA 0.8826
601 OTD 0.8826
602 APS 0.8826
603 6GU 0.8824
604 JB5 0.8824
605 MQN 0.8823
606 290 0.8820
607 GCW 0.8820
608 SW7 0.8820
609 DRL 0.8820
610 6VD 0.8818
611 CXH 0.8817
612 JB8 0.8816
613 ES5 0.8815
614 03V 0.8815
615 6PC 0.8814
616 4FS 0.8814
617 6CS 0.8814
618 ZYR 0.8813
619 PA1 0.8813
620 AJV 0.8812
621 C9E 0.8811
622 GLU 0.8810
623 HNK 0.8810
624 IF7 0.8810
625 FP1 0.8810
626 5MK 0.8810
627 ARP 0.8810
628 7ZE 0.8809
629 PJW 0.8809
630 8TX 0.8807
631 INE 0.8807
632 5NU 0.8807
633 TYL 0.8807
634 61O 0.8806
635 NCT 0.8804
636 CXF 0.8804
637 7CT 0.8804
638 NAG 0.8802
639 BK9 0.8800
640 DX4 0.8799
641 XAN 0.8799
642 A2F 0.8798
643 WOO 0.8797
644 C1M 0.8797
645 GTL 0.8796
646 G12 0.8796
647 209 0.8796
648 NCA 0.8796
649 LI6 0.8795
650 HQ9 0.8795
651 ZZ3 0.8793
652 7MX 0.8793
653 HH5 0.8792
654 FBB 0.8792
655 BTY 0.8791
656 PNZ 0.8791
657 2ZQ 0.8790
658 4JT 0.8790
659 ET2 0.8790
660 717 0.8789
661 AHR 0.8789
662 LKA 0.8788
663 HXX 0.8788
664 0TU 0.8788
665 YO5 0.8788
666 BMA 0.8787
667 DQU 0.8787
668 SXS 0.8786
669 ISZ 0.8785
670 MQB 0.8785
671 GLN 0.8785
672 BEZ 0.8784
673 QX4 0.8784
674 TGX 0.8784
675 BCK 0.8784
676 1IT 0.8783
677 BZ3 0.8783
678 LT8 0.8782
679 PEY 0.8782
680 5OF 0.8781
681 QBK 0.8781
682 M4T 0.8780
683 B55 0.8779
684 141 0.8779
685 XHP 0.8779
686 6AP 0.8778
687 F6P 0.8778
688 BE2 0.8778
689 M1H 0.8777
690 82I 0.8777
691 FBM 0.8777
692 FWB 0.8775
693 BPN 0.8775
694 9CA 0.8774
695 CLW 0.8774
696 2FY 0.8773
697 LIP 0.8773
698 FDB 0.8773
699 IPZ 0.8772
700 AVI 0.8771
701 GXY 0.8771
702 BHO 0.8771
703 6BL 0.8770
704 YH7 0.8770
705 K2T 0.8769
706 4YO 0.8769
707 XXP 0.8769
708 5JL 0.8768
709 36Y 0.8767
710 4BZ 0.8765
711 BSP 0.8764
712 MVN 0.8764
713 AZG 0.8763
714 ZZZ 0.8763
715 1M2 0.8762
716 BEN 0.8762
717 1WC 0.8760
718 AZA 0.8759
719 TZM 0.8759
720 RUY 0.8758
721 G3P 0.8756
722 DNA 0.8756
723 BOQ 0.8756
724 SAL 0.8755
725 PDC 0.8754
726 13P 0.8754
727 IPB 0.8753
728 MXD 0.8753
729 0FO 0.8752
730 7B4 0.8751
731 ES2 0.8750
732 BPU 0.8750
733 261 0.8749
734 36R 0.8747
735 4NM 0.8747
736 SN4 0.8746
737 AX7 0.8746
738 270 0.8746
739 FDR 0.8746
740 G5V 0.8745
741 PD2 0.8743
742 463 0.8743
743 BZJ 0.8742
744 HCI 0.8741
745 SRT 0.8740
746 WOT 0.8740
747 OHP 0.8740
748 8HC 0.8739
749 5GU 0.8739
750 6R8 0.8739
751 TRA 0.8738
752 G6D 0.8737
753 1P7 0.8734
754 2MI 0.8734
755 7MH 0.8731
756 H62 0.8731
757 ABV 0.8731
758 M6Z 0.8730
759 TIU 0.8730
760 F9P 0.8729
761 GL1 0.8727
762 FBG 0.8725
763 44W 0.8725
764 ESX 0.8722
765 YCP 0.8722
766 9R5 0.8722
767 6J9 0.8721
768 HC4 0.8720
769 PBC 0.8716
770 X0W 0.8715
771 2HG 0.8714
772 1X7 0.8713
773 TEP 0.8713
774 AL0 0.8712
775 IGA 0.8712
776 NIO 0.8712
777 T6C 0.8712
778 9UL 0.8711
779 GCO 0.8711
780 OGA 0.8710
781 BNS 0.8710
782 15E 0.8708
783 8K2 0.8707
784 2BG 0.8706
785 JAW 0.8706
786 KIB 0.8703
787 R67 0.8703
788 GOG 0.8702
789 4RU 0.8702
790 1P8 0.8701
791 8G0 0.8701
792 OKM 0.8700
793 F4E 0.8700
794 8IG 0.8699
795 BAM 0.8699
796 PHE 0.8698
797 KIA 0.8696
798 6M9 0.8696
799 7HQ 0.8696
800 GJP 0.8696
801 27B 0.8696
802 TSS 0.8694
803 PH2 0.8692
804 AKG 0.8692
805 AJY 0.8692
806 AMG 0.8691
807 2EC 0.8691
808 3U4 0.8691
809 BOA 0.8691
810 I3A 0.8691
811 4FA 0.8691
812 28N 0.8689
813 2SX 0.8689
814 1XM 0.8688
815 JF6 0.8688
816 23A 0.8688
817 NHG 0.8688
818 APG 0.8687
819 K6X 0.8687
820 JKE 0.8687
821 SYV 0.8686
822 TQU 0.8686
823 M1E 0.8686
824 7I2 0.8685
825 MAN 0.8685
826 MOK 0.8685
827 I3E 0.8685
828 MAQ 0.8684
829 SVN 0.8684
830 8WZ 0.8684
831 BPY 0.8683
832 CKA 0.8683
833 W8G 0.8683
834 KJU 0.8680
835 3Y7 0.8680
836 Z13 0.8680
837 H33 0.8678
838 TT4 0.8678
839 KJY 0.8677
840 ADZ 0.8677
841 AC0 0.8677
842 5LA 0.8676
843 KDF 0.8675
844 IWT 0.8675
845 LSA 0.8675
846 XQ0 0.8674
847 ES6 0.8674
848 UNU 0.8674
849 SWD 0.8672
850 BZE 0.8670
851 HBA 0.8668
852 10L 0.8668
853 Q71 0.8665
854 37T 0.8665
855 AEF 0.8665
856 30G 0.8664
857 TBP 0.8663
858 14O 0.8663
859 M2K 0.8663
860 TH7 0.8663
861 ADE 0.8663
862 GNM 0.8663
863 B57 0.8662
864 I3C 0.8662
865 B60 0.8661
866 5H1 0.8661
867 4NZ 0.8661
868 I1E 0.8660
869 4SV 0.8658
870 FAN 0.8657
871 4V2 0.8657
872 3SK 0.8657
873 HPA 0.8657
874 IP0 0.8657
875 DPZ 0.8656
876 NBZ 0.8656
877 QBS 0.8654
878 DHQ 0.8653
879 K17 0.8653
880 BRV 0.8652
881 PYQ 0.8651
882 MZM 0.8651
883 344 0.8650
884 ABF 0.8650
885 PZA 0.8649
886 F60 0.8649
887 0CU 0.8649
888 YRL 0.8648
889 6QF 0.8648
890 6AI 0.8646
891 SS2 0.8645
892 428 0.8644
893 OAA 0.8644
894 N2I 0.8644
895 LMR 0.8642
896 NTN 0.8642
897 25W 0.8641
898 0GY 0.8639
899 TNF 0.8639
900 SS1 0.8636
901 M5N 0.8636
902 4TU 0.8635
903 2V0 0.8635
904 F05 0.8634
905 B53 0.8634
906 BCP 0.8634
907 535 0.8633
908 VGL 0.8632
909 SRO 0.8632
910 4VP 0.8631
911 32X 0.8631
912 NPY 0.8629
913 QUZ 0.8628
914 K32 0.8628
915 FLC 0.8627
916 PBA 0.8627
917 UNJ 0.8625
918 7WV 0.8625
919 K34 0.8625
920 VNJ 0.8625
921 MLT 0.8625
922 DIE 0.8624
923 8XL 0.8624
924 54X 0.8623
925 6MP 0.8620
926 PFL 0.8619
927 V1T 0.8619
928 3R6 0.8619
929 5B1 0.8619
930 TNL 0.8614
931 6KT 0.8609
932 5VM 0.8608
933 3YP 0.8607
934 11S 0.8603
935 NCD 0.8600
936 VGD 0.8600
937 F2W 0.8599
938 AN3 0.8598
939 HA7 0.8598
940 MPV 0.8598
941 MXN 0.8596
942 BZX 0.8595
943 EUE 0.8595
944 E7R 0.8594
945 NDG 0.8587
946 KTJ 0.8586
947 5VL 0.8586
948 ES4 0.8586
949 STT 0.8586
950 E3D 0.8585
951 IBM 0.8584
952 NQH 0.8582
953 JFD 0.8581
954 DHR 0.8577
955 A5E 0.8577
956 ASP 0.8577
957 35C 0.8571
958 GZ2 0.8569
959 GUA 0.8568
960 1U1 0.8567
961 JAE 0.8563
962 DC5 0.8562
963 TBS 0.8560
964 7VP 0.8560
965 ANC 0.8558
966 EN1 0.8556
967 HMH 0.8555
968 1WD 0.8555
969 3WA 0.8554
970 2K8 0.8551
971 1FF 0.8550
972 68A 0.8550
973 TLM 0.8548
974 4NB 0.8547
975 12M 0.8543
976 K25 0.8541
977 MNN 0.8541
978 4BY 0.8540
979 AA 0.8540
980 3DM 0.8538
981 1Z6 0.8536
982 J9N 0.8533
983 QBM 0.8528
984 C2B 0.8524
985 ID2 0.8518
986 PH3 0.8507
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6SI3; Ligand: LEB; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 6si3.bio2) has 21 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 6SI3; Ligand: LEB; 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: 6si3.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
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