Receptor
PDB id Resolution Class Description Source Keywords
2X0W 2.1 Å NON-ENZYME: BINDING STRUCTURE OF THE P53 CORE DOMAIN MUTANT Y220C BOUND TO 5,6-D 2-METHYLBENZOTHIAZOLE HOMO SAPIENS ACTIVATOR CELL CYCLE HOST-VIRUS INTERACTION TRANSCRIPTIONREGULATION TRANSCRIPTION FACTOR LI-FRAUMENI SYNDROME DRUDISCOVERY SURFACE CREVICE TUMOR SUPPRESSOR PROTEIN STABITRANSCRIPTION CANCER APOPTOSIS
Ref.: TOWARD THE RATIONAL DESIGN OF P53-STABILIZING DRUGS THE SURFACE OF THE ONCOGENIC Y220C MUTANT. CHEM.BIOL. V. 17 46 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
X0W B:1291;
 Valid;
 none;
 submit data
209.265 C10 H11 N O2 S Cc1nc...
ZN A:1300;
B:1300;
 Part of Protein;
Part of Protein;
 none;
none;
 submit data
65.409 Zn [Zn+2...
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: X0W; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 X0W 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: X0W; Similar ligands found: 719
No: Ligand Similarity coefficient
1 F2W 0.9781
2 15E 0.9510
3 GF4 0.9494
4 4MU 0.9492
5 AY4 0.9483
6 BPU 0.9482
7 BZE 0.9468
8 0W1 0.9455
9 TWO 0.9437
10 1KP 0.9422
11 M1Z 0.9410
12 7ME 0.9408
13 MPV 0.9392
14 EN1 0.9386
15 E35 0.9384
16 E7S 0.9361
17 X0U 0.9346
18 VXX 0.9324
19 JG8 0.9298
20 QBS 0.9293
21 6RQ 0.9291
22 BZJ 0.9289
23 8NB 0.9288
24 VOH 0.9288
25 3PF 0.9285
26 JR2 0.9276
27 692 0.9272
28 5QY 0.9269
29 KT7 0.9261
30 M3E 0.9260
31 LDP 0.9256
32 URC 0.9254
33 BGU 0.9249
34 KW8 0.9248
35 JP2 0.9245
36 AH9 0.9242
37 X11 0.9234
38 0XT 0.9223
39 F31 0.9222
40 AEH 0.9219
41 AX3 0.9216
42 IQ5 0.9213
43 AJY 0.9212
44 L5V 0.9207
45 344 0.9206
46 8IG 0.9205
47 8NX 0.9202
48 MUA 0.9199
49 2AK 0.9188
50 B55 0.9184
51 FHC 0.9178
52 HQJ 0.9178
53 NGT 0.9178
54 DIN 0.9176
55 BIK 0.9175
56 ANC 0.9175
57 VNL 0.9174
58 75K 0.9174
59 9AP 0.9174
60 CNI 0.9171
61 G3E 0.9170
62 R20 0.9166
63 NAG 0.9165
64 8TX 0.9165
65 EUG 0.9164
66 NGO 0.9161
67 94W 0.9153
68 HRM 0.9153
69 6QF 0.9152
70 8WO 0.9149
71 HQD 0.9147
72 J6W 0.9147
73 M5N 0.9146
74 A29 0.9142
75 4ME 0.9141
76 HBO 0.9141
77 LDR 0.9138
78 MRW 0.9134
79 CWJ 0.9132
80 8W9 0.9131
81 XM5 0.9126
82 GSY 0.9125
83 A7W 0.9124
84 9FL 0.9124
85 KJU 0.9117
86 GNM 0.9116
87 J5I 0.9114
88 GZL 0.9111
89 6FB 0.9110
90 BQ5 0.9109
91 NDG 0.9108
92 BPY 0.9103
93 CIY 0.9101
94 DNF 0.9100
95 V55 0.9099
96 5JL 0.9096
97 9R5 0.9094
98 3QV 0.9094
99 S60 0.9093
100 D48 0.9092
101 ESI 0.9091
102 EV0 0.9089
103 XAZ 0.9086
104 4JQ 0.9085
105 6Q3 0.9084
106 4V2 0.9083
107 QBK 0.9082
108 0N7 0.9075
109 JND 0.9075
110 SE2 0.9073
111 YTX 0.9071
112 SYV 0.9068
113 2FQ 0.9066
114 5RO 0.9064
115 F0J 0.9063
116 PHE 0.9062
117 PH2 0.9060
118 TT4 0.9059
119 B4O 0.9059
120 N8Y 0.9059
121 0F9 0.9057
122 0FO 0.9055
123 DX3 0.9054
124 AH3 0.9053
125 7I2 0.9051
126 FUD 0.9045
127 9UG 0.9043
128 H7Y 0.9042
129 SYR 0.9041
130 8WZ 0.9040
131 8G6 0.9039
132 4HM 0.9038
133 BTY 0.9033
134 G12 0.9031
135 K3Q 0.9030
136 KUF 0.9028
137 209 0.9027
138 1Z6 0.9027
139 069 0.9026
140 8ZE 0.9024
141 7WR 0.9023
142 AJ2 0.9022
143 BZ2 0.9018
144 ALE 0.9017
145 226 0.9016
146 JU2 0.9015
147 9LI 0.9014
148 HIS 0.9011
149 BGC 0.9010
150 JXN 0.9008
151 6TZ 0.9005
152 L22 0.9005
153 AJV 0.9005
154 D07 0.9005
155 GHM 0.9003
156 KWH 0.9003
157 ORO 0.9003
158 QX4 0.9003
159 DNQ 0.9002
160 AH6 0.9001
161 C2U 0.9001
162 DMD 0.9000
163 2JK 0.8999
164 ZYQ 0.8999
165 4BY 0.8996
166 XDE 0.8996
167 DHB 0.8996
168 AZ9 0.8996
169 KTW 0.8995
170 N7I 0.8995
171 H33 0.8994
172 FLV 0.8993
173 5GU 0.8993
174 30G 0.8992
175 3VX 0.8990
176 UFO 0.8990
177 3ID 0.8989
178 55D 0.8988
179 KTJ 0.8987
180 ZME 0.8987
181 CKA 0.8987
182 4VY 0.8987
183 C9E 0.8986
184 0W8 0.8986
185 SG2 0.8986
186 XHP 0.8985
187 5JQ 0.8984
188 8WT 0.8983
189 XQK 0.8983
190 4YO 0.8979
191 DQU 0.8979
192 OTW 0.8979
193 EV3 0.8979
194 ONR 0.8978
195 GNV 0.8976
196 6ME 0.8976
197 AQO 0.8976
198 GLC 0.8975
199 4TU 0.8975
200 V1T 0.8971
201 INO 0.8970
202 M5K 0.8968
203 IWT 0.8967
204 ODO 0.8964
205 JTA 0.8964
206 CH9 0.8963
207 X8D 0.8962
208 1M2 0.8960
209 KIB 0.8960
210 FF2 0.8960
211 15N 0.8958
212 4M4 0.8957
213 78Y 0.8957
214 DIU 0.8957
215 6KT 0.8956
216 ROI 0.8956
217 PXL 0.8956
218 93K 0.8955
219 DK1 0.8953
220 B62 0.8953
221 M0W 0.8951
222 0HO 0.8950
223 NBG 0.8947
224 92P 0.8947
225 PQK 0.8945
226 KYA 0.8944
227 ES2 0.8943
228 B21 0.8942
229 SRO 0.8942
230 P9P 0.8940
231 MYJ 0.8940
232 4A5 0.8939
233 QWN 0.8939
234 2WU 0.8938
235 MXD 0.8936
236 8XQ 0.8935
237 AW5 0.8934
238 1A7 0.8934
239 H05 0.8933
240 ENO 0.8932
241 1F1 0.8931
242 DRG 0.8928
243 HA5 0.8928
244 0JD 0.8927
245 MS9 0.8927
246 M0Q 0.8927
247 B60 0.8926
248 CHB 0.8924
249 PE0 0.8924
250 ITE 0.8924
251 463 0.8924
252 DRL 0.8922
253 APZ 0.8922
254 TGX 0.8920
255 LT2 0.8920
256 HJP 0.8920
257 B2J 0.8920
258 LDC 0.8919
259 4HC 0.8919
260 OXC 0.8919
261 DHC 0.8918
262 W8G 0.8917
263 M6N 0.8917
264 HLZ 0.8917
265 TXW 0.8917
266 EWG 0.8916
267 34D 0.8916
268 GVG 0.8915
269 1VK 0.8914
270 97T 0.8913
271 0HN 0.8912
272 IHB 0.8912
273 N91 0.8912
274 6X9 0.8912
275 DX1 0.8910
276 549 0.8910
277 XDK 0.8909
278 HLD 0.8908
279 1X7 0.8908
280 QXW 0.8908
281 RKV 0.8908
282 D3G 0.8906
283 MAQ 0.8906
284 39O 0.8906
285 GT0 0.8906
286 Q24 0.8905
287 4RU 0.8903
288 6NT 0.8903
289 J9Q 0.8903
290 J9W 0.8902
291 WUB 0.8901
292 AZ8 0.8901
293 L99 0.8900
294 1P8 0.8899
295 DBJ 0.8898
296 ASC 0.8897
297 FOT 0.8897
298 MQN 0.8896
299 CLZ 0.8896
300 091 0.8896
301 FBG 0.8896
302 M1H 0.8896
303 QSH 0.8894
304 3Y7 0.8894
305 HHS 0.8894
306 MVN 0.8893
307 6BL 0.8893
308 M1Q 0.8892
309 AN3 0.8891
310 K22 0.8891
311 3R6 0.8891
312 HNQ 0.8891
313 CWS 0.8890
314 BCU 0.8889
315 DOR 0.8889
316 428 0.8888
317 OCZ 0.8888
318 ZHA 0.8887
319 4AV 0.8886
320 XQ0 0.8886
321 VM1 0.8885
322 UNJ 0.8884
323 I6G 0.8884
324 K32 0.8882
325 2HO 0.8882
326 9TW 0.8881
327 4I8 0.8880
328 UNC 0.8879
329 KOJ 0.8878
330 5OF 0.8877
331 GDL 0.8877
332 5GV 0.8876
333 2J2 0.8876
334 7B3 0.8875
335 FDR 0.8874
336 N2I 0.8873
337 ZYR 0.8873
338 S98 0.8873
339 HDH 0.8872
340 4NC 0.8872
341 44V 0.8872
342 3J8 0.8871
343 4AA 0.8871
344 GJP 0.8870
345 GDE 0.8870
346 A5H 0.8870
347 6VD 0.8870
348 PRZ 0.8870
349 7VS 0.8869
350 C8O 0.8867
351 PQ0 0.8866
352 2AL 0.8865
353 YO5 0.8863
354 0FK 0.8863
355 7FF 0.8861
356 MEW 0.8859
357 3MG 0.8859
358 5F5 0.8855
359 J9T 0.8855
360 TR4 0.8853
361 F12 0.8853
362 9FE 0.8853
363 EXD 0.8853
364 9ZE 0.8852
365 6FZ 0.8852
366 GNY 0.8851
367 2ZM 0.8851
368 P84 0.8849
369 5VJ 0.8849
370 2BG 0.8848
371 JAW 0.8848
372 H5B 0.8847
373 VGD 0.8846
374 20J 0.8846
375 Q71 0.8845
376 878 0.8842
377 THA 0.8842
378 2HQ 0.8841
379 LEL 0.8841
380 GXY 0.8840
381 6NI 0.8840
382 F4E 0.8840
383 5F8 0.8838
384 IJZ 0.8838
385 LNR 0.8838
386 TOF 0.8837
387 A7H 0.8834
388 FGZ 0.8834
389 5VM 0.8833
390 CTS 0.8833
391 DNC 0.8832
392 CWM 0.8832
393 54X 0.8832
394 N3W 0.8830
395 PJW 0.8830
396 D1X 0.8828
397 7MU 0.8827
398 44W 0.8827
399 A13 0.8826
400 2LY 0.8825
401 BDP 0.8824
402 86J 0.8824
403 12T 0.8824
404 P9I 0.8821
405 2D3 0.8821
406 KJY 0.8820
407 Q88 0.8820
408 982 0.8817
409 2F6 0.8814
410 FER 0.8813
411 64C 0.8813
412 NOJ 0.8813
413 9UL 0.8811
414 ET2 0.8811
415 9MG 0.8811
416 67X 0.8811
417 BEA 0.8810
418 M5H 0.8810
419 1IT 0.8810
420 FBB 0.8810
421 ICB 0.8809
422 JXW 0.8808
423 5TY 0.8808
424 4NO 0.8807
425 9CA 0.8807
426 3A9 0.8806
427 LJ3 0.8803
428 LI6 0.8803
429 SXS 0.8802
430 JYB 0.8800
431 PRF 0.8800
432 MO8 0.8799
433 UEG 0.8799
434 I3E 0.8799
435 3IT 0.8797
436 0P6 0.8796
437 0GZ 0.8794
438 OKM 0.8794
439 2EC 0.8793
440 9KT 0.8793
441 EGR 0.8792
442 3R4 0.8790
443 FE DB1 0.8790
444 SQ4 0.8789
445 KKN 0.8788
446 2GQ 0.8787
447 ABI 0.8787
448 HNK 0.8786
449 K2T 0.8786
450 CKU 0.8785
451 68A 0.8784
452 42J 0.8783
453 K3Y 0.8783
454 Z5P 0.8781
455 4FF 0.8780
456 5OB 0.8780
457 36M 0.8780
458 EMZ 0.8780
459 JLZ 0.8779
460 GNJ 0.8777
461 4A3 0.8773
462 PEY 0.8772
463 ES0 0.8772
464 0TU 0.8772
465 1X8 0.8770
466 BQ2 0.8770
467 5WT 0.8768
468 5VL 0.8768
469 PDC 0.8767
470 2D2 0.8767
471 CCV 0.8767
472 N2M 0.8765
473 WSD 0.8764
474 5XC 0.8763
475 HHR 0.8761
476 H4E 0.8761
477 QWW 0.8759
478 B5D 0.8755
479 FBU 0.8754
480 QPR 0.8753
481 KDV 0.8751
482 293 0.8750
483 NCT 0.8750
484 6R8 0.8749
485 3HM 0.8749
486 8HC 0.8749
487 C2Y 0.8749
488 DNA 0.8748
489 DDU 0.8745
490 582 0.8743
491 BK9 0.8742
492 FHB 0.8741
493 GZ2 0.8740
494 H42 0.8739
495 NTZ 0.8738
496 4M0 0.8737
497 4XF 0.8737
498 GNL 0.8734
499 8CM 0.8734
500 K37 0.8734
501 ISN 0.8733
502 NNO 0.8733
503 BGP 0.8731
504 795 0.8731
505 8XL 0.8730
506 OSB 0.8730
507 BZ3 0.8730
508 QAT 0.8730
509 OTD 0.8730
510 GAL 0.8729
511 GM7 0.8727
512 5WY 0.8727
513 6ZW 0.8726
514 GZ8 0.8725
515 D2G 0.8725
516 X48 0.8725
517 XFE 0.8724
518 39U 0.8723
519 36R 0.8722
520 W29 0.8721
521 3MB 0.8721
522 E1T 0.8721
523 R8Y 0.8721
524 MJ2 0.8719
525 UAN 0.8716
526 UFV 0.8715
527 4VS 0.8714
528 JA8 0.8713
529 YQA 0.8712
530 4Z4 0.8712
531 QSB 0.8712
532 ES7 0.8711
533 G3F 0.8710
534 6OT 0.8710
535 XX2 0.8710
536 173 0.8709
537 IV2 0.8709
538 OCH 0.8708
539 363 0.8707
540 3Z8 0.8707
541 V2Z 0.8707
542 DCZ 0.8707
543 2O6 0.8706
544 4F8 0.8705
545 OVM 0.8705
546 DOB 0.8704
547 JTH 0.8702
548 5NI 0.8700
549 1NP 0.8700
550 8S0 0.8700
551 2KA 0.8698
552 45L 0.8697
553 1Z8 0.8697
554 URI 0.8697
555 DXK 0.8696
556 SKM 0.8695
557 SKA 0.8695
558 BCP 0.8694
559 EY7 0.8694
560 GJS 0.8694
561 DUR 0.8694
562 H70 0.8694
563 QMS 0.8693
564 DHK 0.8693
565 EPR 0.8692
566 AA 0.8690
567 TNF 0.8690
568 IPT 0.8690
569 2D0 0.8688
570 PD2 0.8684
571 7ZE 0.8684
572 IL5 0.8684
573 SWA 0.8683
574 4BL 0.8683
575 LGC 0.8682
576 1P7 0.8682
577 2FY 0.8681
578 GCS 0.8679
579 X05 0.8679
580 1SQ 0.8678
581 INE 0.8678
582 HKD 0.8677
583 0LO 0.8676
584 FA0 0.8676
585 DT7 0.8676
586 AVR 0.8674
587 CLW 0.8674
588 0BP 0.8674
589 GYE 0.8673
590 COU 0.8672
591 774 0.8671
592 Q6T 0.8670
593 NOK 0.8669
594 NDH 0.8666
595 5FL 0.8665
596 CFA 0.8661
597 OW4 0.8659
598 ES5 0.8659
599 RUY 0.8659
600 ANF 0.8659
601 MMJ 0.8658
602 1LQ 0.8658
603 B23 0.8657
604 BHA 0.8657
605 RD4 0.8657
606 03V 0.8656
607 MS0 0.8656
608 4XV 0.8656
609 CK2 0.8654
610 7W4 0.8654
611 X6W 0.8652
612 OA3 0.8651
613 4FS 0.8651
614 CFF 0.8649
615 2AQ 0.8649
616 MIG 0.8649
617 GTR 0.8648
618 K68 0.8648
619 6PB 0.8647
620 FRU 0.8647
621 NID 0.8647
622 E7Z 0.8646
623 61M 0.8645
624 MUK 0.8645
625 K44 0.8644
626 6DP 0.8642
627 8HH 0.8642
628 I3A 0.8642
629 M3H 0.8642
630 1HN 0.8641
631 NQ 0.8640
632 Q7A 0.8639
633 M2K 0.8639
634 5RN 0.8639
635 9KH 0.8638
636 2ZQ 0.8638
637 1LM 0.8636
638 24W 0.8636
639 4I5 0.8636
640 6XI 0.8633
641 NDM 0.8632
642 F5C 0.8631
643 6HP 0.8631
644 1QP 0.8630
645 3HB 0.8630
646 25O 0.8628
647 QAS 0.8628
648 G2F 0.8628
649 VK3 0.8627
650 4XS 0.8627
651 K25 0.8626
652 DHQ 0.8626
653 ICO 0.8625
654 7MX 0.8625
655 DPT 0.8624
656 7MK 0.8624
657 FQX 0.8623
658 DEW 0.8621
659 KFH 0.8621
660 2HU 0.8621
661 TEP 0.8620
662 F02 0.8616
663 JBH 0.8614
664 32X 0.8613
665 KLV 0.8613
666 W81 0.8613
667 2GS 0.8613
668 N5J 0.8612
669 M1E 0.8611
670 5WV 0.8607
671 R8V 0.8607
672 52C 0.8606
673 Q77 0.8606
674 GAB 0.8603
675 537 0.8602
676 QX2 0.8600
677 MOK 0.8599
678 O72 0.8599
679 2H5 0.8597
680 CN0 0.8597
681 CB1 0.8597
682 DPZ 0.8597
683 4FH 0.8595
684 XX3 0.8592
685 OW7 0.8589
686 5TZ 0.8586
687 ES1 0.8585
688 LZM 0.8582
689 EV2 0.8581
690 DGJ 0.8581
691 QQQ 0.8581
692 EA1 0.8580
693 42C 0.8579
694 5IQ 0.8576
695 AIN 0.8574
696 GCU 0.8572
697 RXA 0.8571
698 JPZ 0.8570
699 4XH 0.8570
700 5SG 0.8566
701 JF2 0.8566
702 8G0 0.8564
703 28N 0.8563
704 4YS 0.8558
705 JB5 0.8558
706 ZB1 0.8558
707 680 0.8556
708 HQT 0.8553
709 L03 0.8551
710 ST1 0.8546
711 GTQ 0.8546
712 4JT 0.8543
713 IPD 0.8538
714 ST3 0.8536
715 5Q0 0.8532
716 GLY PRO 0.8532
717 HQY 0.8531
718 42A 0.8527
719 PXM 0.8519
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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