Receptor
PDB id Resolution Class Description Source Keywords
5B4O 1.37 Å EC: 5.3.2.1 CRYSTAL STRUCTURE OF MACROPHAGE MIGRATION INHIBITORY FACTOR WITH BTZO-14 HOMO SAPIENS ISOMERASE
Ref.: BTZO-1, A CARDIOPROTECTIVE AGENT, REVEALS THAT MACR MIGRATION INHIBITORY FACTOR REGULATES ARE-MEDIATED EXPRESSION CHEM. BIOL. V. 17 1282 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
SO4 A:207;
A:205;
C:202;
B:203;
B:204;
B:205;
A:203;
A:204;
A:206;
 Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
 none;
none;
none;
none;
none;
none;
none;
none;
none;
 submit data
96.063 O4 S [O-]S...
6DQ B:202;
A:201;
C:201;
B:201;
 Valid;
Valid;
Valid;
Valid;
 none;
none;
none;
none;
 submit data
240.28 C13 H8 N2 O S c1ccc...
EDO A:202;
 Invalid;
 none;
 submit data
62.068 C2 H6 O2 C(CO)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3L5R 1.94 Å EC: 5.3.2.1 CRYSTAL STRUCTURE OF MACROPHAGE MIGRATION INHIBITORY FACTOR PHENYLCHROMENONE INHIBITOR AT 1.94A RESOLUTION HOMO SAPIENS PROTEIN-LIGAND COMPLEX CYTOKINE CYTOPLASM IMMUNE RESPONSEINFLAMMATORY RESPONSE INNATE IMMUNITY ISOMERASE PHOSPHOPSECRETED ACETYLATION
Ref.: FRAGMENT SCREENING OF INHIBITORS FOR MIF TAUTOMERAS A CRYPTIC SURFACE BINDING SITE. BIOORG.MED.CHEM.LETT. V. 20 1821 2010
Members (27)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1LJT ic50 = 7 uM HDI C12 H13 N O4 COC(=O)C[C....
2 3L5R ic50 = 38 nM 47X C15 H10 O5 c1cc(c(cc1....
3 5J7Q Ki = 26.6 uM 6H2 C13 H10 N2 O2 c1ccn2cc(n....
4 5HVT Kd = 0.055 uM NVS C15 H13 N O4 COc1ccc(cc....
5 5B4O - 6DQ C13 H8 N2 O S c1ccc2c(c1....
6 1GCZ Ki = 7.4 uM YZ9 C12 H10 O5 CCOC(=O)C1....
7 3L5P - 428 C9 H11 N3 O CC(C)c1cn2....
8 5HVS Kd = 0.071 uM 65V C24 H15 F N4 O4 c1cc(cc(c1....
9 6B1C Kd = 0.111 uM C9J C17 H12 F N5 O2 CN1C=Cc2cc....
10 3L5T - 956 C20 H18 N4 O2 S CN1c2ccccc....
11 3IJJ - EN1 C9 H8 O4 c1cc(ccc1/....
12 6CBG Ki = 113 uM EWG C10 H8 N2 O2 c1cc(cc(c1....
13 4K9G - 1Q1 C12 H12 F N O3 CC(=O)C[C@....
14 3IJG Kd = 54 uM AVR C13 H17 N3 O C[C@H](C(=....
15 4WRB Ki = 0.65 uM 3TW C20 H18 N4 O3 COCCOc1ccc....
16 1CA7 - ENO C9 H8 O4 c1cc(ccc1C....
17 2OOH ic50 = 1.3 uM OX3 C14 H17 N O3 c1cc(ccc1C....
18 2OOZ ic50 = 7 uM OX5 C13 H17 N O3 CC(C)(C)CC....
19 3DJI - 3E1 C16 H16 N2 O4 CC(=O)Nc1c....
20 6CBF Ki = 6.8 uM EWD C16 H12 N2 O3 c1ccc(cc1)....
21 3L5U - ZEC C7 H6 N2 O3 S2 c1cc2c(cc1....
22 6CB5 Ki = 4.3 uM EV7 C20 H14 N2 O3 c1ccc2cc(c....
23 6B1K Kd = 0.213 uM C9G C17 H13 N5 O2 CN1C=Cc2cc....
24 3L5S - 88X C15 H13 N3 O2 CCC1=CC(=O....
25 6CBH Ki = 0.51 uM EWJ C20 H13 F N2 O3 c1ccc2cc(c....
26 3U18 ic50 = 0.81 uM Y0X C34 H28 N6 O16 S4 COc1c(ccc(....
27 6B2C Kd = 0.094 uM C9Y C18 H12 F N5 O4 c1cc(c(cc1....
70% Homology Family (28)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1LJT ic50 = 7 uM HDI C12 H13 N O4 COC(=O)C[C....
2 3L5R ic50 = 38 nM 47X C15 H10 O5 c1cc(c(cc1....
3 5J7Q Ki = 26.6 uM 6H2 C13 H10 N2 O2 c1ccn2cc(n....
4 5HVT Kd = 0.055 uM NVS C15 H13 N O4 COc1ccc(cc....
5 5B4O - 6DQ C13 H8 N2 O S c1ccc2c(c1....
6 1GCZ Ki = 7.4 uM YZ9 C12 H10 O5 CCOC(=O)C1....
7 3L5P - 428 C9 H11 N3 O CC(C)c1cn2....
8 5HVS Kd = 0.071 uM 65V C24 H15 F N4 O4 c1cc(cc(c1....
9 6B1C Kd = 0.111 uM C9J C17 H12 F N5 O2 CN1C=Cc2cc....
10 3L5T - 956 C20 H18 N4 O2 S CN1c2ccccc....
11 3IJJ - EN1 C9 H8 O4 c1cc(ccc1/....
12 6CBG Ki = 113 uM EWG C10 H8 N2 O2 c1cc(cc(c1....
13 4K9G - 1Q1 C12 H12 F N O3 CC(=O)C[C@....
14 3IJG Kd = 54 uM AVR C13 H17 N3 O C[C@H](C(=....
15 4WRB Ki = 0.65 uM 3TW C20 H18 N4 O3 COCCOc1ccc....
16 1CA7 - ENO C9 H8 O4 c1cc(ccc1C....
17 2OOH ic50 = 1.3 uM OX3 C14 H17 N O3 c1cc(ccc1C....
18 2OOZ ic50 = 7 uM OX5 C13 H17 N O3 CC(C)(C)CC....
19 3DJI - 3E1 C16 H16 N2 O4 CC(=O)Nc1c....
20 6CBF Ki = 6.8 uM EWD C16 H12 N2 O3 c1ccc(cc1)....
21 3L5U - ZEC C7 H6 N2 O3 S2 c1cc2c(cc1....
22 6CB5 Ki = 4.3 uM EV7 C20 H14 N2 O3 c1ccc2cc(c....
23 6B1K Kd = 0.213 uM C9G C17 H13 N5 O2 CN1C=Cc2cc....
24 3L5S - 88X C15 H13 N3 O2 CCC1=CC(=O....
25 6CBH Ki = 0.51 uM EWJ C20 H13 F N2 O3 c1ccc2cc(c....
26 3U18 ic50 = 0.81 uM Y0X C34 H28 N6 O16 S4 COc1c(ccc(....
27 6B2C Kd = 0.094 uM C9Y C18 H12 F N5 O4 c1cc(c(cc1....
28 1MFI Ki = 2.6 uM FHC C9 H6 F O3 c1cc(ccc1C....
50% Homology Family (32)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1LJT ic50 = 7 uM HDI C12 H13 N O4 COC(=O)C[C....
2 3L5R ic50 = 38 nM 47X C15 H10 O5 c1cc(c(cc1....
3 5J7Q Ki = 26.6 uM 6H2 C13 H10 N2 O2 c1ccn2cc(n....
4 5HVT Kd = 0.055 uM NVS C15 H13 N O4 COc1ccc(cc....
5 5B4O - 6DQ C13 H8 N2 O S c1ccc2c(c1....
6 1GCZ Ki = 7.4 uM YZ9 C12 H10 O5 CCOC(=O)C1....
7 3L5P - 428 C9 H11 N3 O CC(C)c1cn2....
8 5HVS Kd = 0.071 uM 65V C24 H15 F N4 O4 c1cc(cc(c1....
9 6B1C Kd = 0.111 uM C9J C17 H12 F N5 O2 CN1C=Cc2cc....
10 3L5T - 956 C20 H18 N4 O2 S CN1c2ccccc....
11 3IJJ - EN1 C9 H8 O4 c1cc(ccc1/....
12 6CBG Ki = 113 uM EWG C10 H8 N2 O2 c1cc(cc(c1....
13 4K9G - 1Q1 C12 H12 F N O3 CC(=O)C[C@....
14 3IJG Kd = 54 uM AVR C13 H17 N3 O C[C@H](C(=....
15 4WRB Ki = 0.65 uM 3TW C20 H18 N4 O3 COCCOc1ccc....
16 1CA7 - ENO C9 H8 O4 c1cc(ccc1C....
17 2OOH ic50 = 1.3 uM OX3 C14 H17 N O3 c1cc(ccc1C....
18 2OOZ ic50 = 7 uM OX5 C13 H17 N O3 CC(C)(C)CC....
19 3DJI - 3E1 C16 H16 N2 O4 CC(=O)Nc1c....
20 6CBF Ki = 6.8 uM EWD C16 H12 N2 O3 c1ccc(cc1)....
21 3L5U - ZEC C7 H6 N2 O3 S2 c1cc2c(cc1....
22 6CB5 Ki = 4.3 uM EV7 C20 H14 N2 O3 c1ccc2cc(c....
23 6B1K Kd = 0.213 uM C9G C17 H13 N5 O2 CN1C=Cc2cc....
24 3L5S - 88X C15 H13 N3 O2 CCC1=CC(=O....
25 6CBH Ki = 0.51 uM EWJ C20 H13 F N2 O3 c1ccc2cc(c....
26 3U18 ic50 = 0.81 uM Y0X C34 H28 N6 O16 S4 COc1c(ccc(....
27 6B2C Kd = 0.094 uM C9Y C18 H12 F N5 O4 c1cc(c(cc1....
28 4Q3F - TLA C4 H6 O6 [C@@H]([C@....
29 6C5F Ki = 33 uM 7L9 C14 H9 N O6 c1cc(cc(c1....
30 3RF5 Ki = 2.37 uM FUZ C12 H11 N O3 c1ccc(c(c1....
31 3RF4 Ki = 0.56 uM FUN C12 H11 Cl N2 O5 S c1cc(oc1)C....
32 1MFI Ki = 2.6 uM FHC C9 H6 F O3 c1cc(ccc1C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 6DQ; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 6DQ 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 6DQ; Similar ligands found: 877
No: Ligand Similarity coefficient
1 F40 0.9845
2 7L4 0.9772
3 RGK 0.9735
4 3F4 0.9702
5 P4L 0.9701
6 NKI 0.9687
7 SZ5 0.9679
8 5NN 0.9671
9 C4E 0.9622
10 1V3 0.9621
11 25F 0.9602
12 3GX 0.9601
13 DFL 0.9594
14 1V4 0.9579
15 PIQ 0.9574
16 CDJ 0.9572
17 9CE 0.9570
18 0DF 0.9569
19 20D 0.9565
20 VT3 0.9561
21 0OK 0.9550
22 M3W 0.9547
23 W8L 0.9545
24 6QT 0.9536
25 E9L 0.9529
26 AVX 0.9522
27 H2W 0.9518
28 1Q4 0.9517
29 1V1 0.9500
30 57D 0.9497
31 7EH 0.9490
32 5B2 0.9490
33 3AK 0.9476
34 WLH 0.9472
35 1HP 0.9467
36 FYR 0.9460
37 NYJ 0.9457
38 DXK 0.9454
39 DDC 0.9452
40 A73 0.9449
41 9JT 0.9445
42 DFV 0.9433
43 3WL 0.9432
44 3D8 0.9421
45 0UL 0.9407
46 HH6 0.9405
47 LIG 0.9403
48 2GQ 0.9398
49 FCW 0.9387
50 91F 0.9377
51 SNJ 0.9369
52 NAL 0.9368
53 A6W 0.9365
54 3JC 0.9364
55 5E5 0.9363
56 2QV 0.9353
57 833 0.9346
58 BZM 0.9341
59 2QU 0.9341
60 0OM 0.9339
61 RSV 0.9338
62 5P3 0.9336
63 LI7 0.9330
64 TRP 0.9329
65 4AU 0.9328
66 O9Z 0.9319
67 LR2 0.9317
68 2JX 0.9316
69 O9Q 0.9312
70 JCZ 0.9311
71 L2K 0.9301
72 6C8 0.9301
73 96Z 0.9299
74 O9T 0.9297
75 2P3 0.9294
76 UAY 0.9291
77 6XC 0.9286
78 LWS 0.9285
79 LU2 0.9284
80 II4 0.9283
81 CX6 0.9281
82 4CN 0.9279
83 1R5 0.9276
84 6C9 0.9273
85 IDZ 0.9272
86 D64 0.9272
87 AGI 0.9271
88 4ZF 0.9269
89 6C5 0.9253
90 3WK 0.9252
91 EV2 0.9247
92 Q0K 0.9247
93 5F8 0.9244
94 6BK 0.9242
95 MJW 0.9239
96 5ER 0.9238
97 0SY 0.9236
98 NIY 0.9235
99 YE7 0.9233
100 08C 0.9232
101 5TO 0.9231
102 4FF 0.9221
103 CU8 0.9220
104 NAR 0.9220
105 JSX 0.9217
106 S1D 0.9216
107 VBC 0.9208
108 Q4G 0.9208
109 UN3 0.9207
110 WDW 0.9205
111 4GU 0.9202
112 D25 0.9201
113 5VU 0.9200
114 5ZM 0.9192
115 A63 0.9191
116 GEN 0.9189
117 5V7 0.9187
118 5S9 0.9187
119 6FG 0.9186
120 L5D 0.9184
121 SQM 0.9183
122 HA6 0.9183
123 LL1 0.9183
124 78Y 0.9182
125 Q2S 0.9181
126 0FR 0.9180
127 0LO 0.9180
128 AVA 0.9178
129 6JO 0.9174
130 H35 0.9170
131 47X 0.9170
132 QUB 0.9170
133 3WN 0.9168
134 3WO 0.9168
135 3VQ 0.9168
136 27F 0.9168
137 E6Q 0.9167
138 NIF 0.9165
139 CWE 0.9163
140 AP6 0.9160
141 X2M 0.9160
142 5FL 0.9158
143 22T 0.9157
144 RVE 0.9156
145 JF5 0.9155
146 4Z9 0.9152
147 IQQ 0.9147
148 JMG 0.9147
149 MHB 0.9146
150 ZAR 0.9145
151 DTR 0.9143
152 52F 0.9143
153 IOP 0.9142
154 TGW 0.9139
155 ZRK 0.9138
156 ZRL 0.9135
157 KWB 0.9134
158 L1T 0.9133
159 CBE 0.9133
160 BIO 0.9131
161 FT6 0.9128
162 EMU 0.9128
163 M4N 0.9127
164 P93 0.9127
165 P2L 0.9127
166 Q5M 0.9126
167 9BF 0.9125
168 BJ4 0.9125
169 272 0.9125
170 AJ4 0.9121
171 VJJ 0.9121
172 XYP XYP 0.9120
173 D26 0.9117
174 RDV 0.9116
175 5M2 0.9114
176 2D2 0.9112
177 5TZ 0.9112
178 H75 0.9111
179 BBY 0.9109
180 KP2 0.9108
181 28A 0.9108
182 4GP 0.9105
183 1UZ 0.9104
184 G2V 0.9102
185 FY8 0.9100
186 3SU 0.9095
187 1FE 0.9090
188 QUE 0.9089
189 6C4 0.9086
190 8CC 0.9084
191 7G0 0.9082
192 GJB 0.9080
193 H4B 0.9080
194 QS4 0.9080
195 CMG 0.9080
196 GJG 0.9079
197 NQ7 0.9079
198 196 0.9077
199 7FZ 0.9076
200 MKN 0.9076
201 97K 0.9075
202 6P3 0.9075
203 JFS 0.9073
204 4G2 0.9071
205 LVY 0.9071
206 L3L 0.9070
207 EF2 0.9070
208 7M2 0.9070
209 363 0.9070
210 4NR 0.9070
211 IQW 0.9070
212 KMP 0.9067
213 B5A 0.9066
214 P4T 0.9066
215 2L1 0.9060
216 3DE 0.9059
217 6JM 0.9057
218 1V8 0.9054
219 8M5 0.9052
220 A9B 0.9049
221 QME 0.9049
222 68B 0.9046
223 7ZO 0.9045
224 QUG 0.9044
225 4L2 0.9043
226 XEV 0.9043
227 7LU 0.9043
228 RK4 0.9043
229 6TJ 0.9042
230 92O 0.9041
231 7VF 0.9041
232 531 0.9040
233 ZSP 0.9040
234 7G2 0.9039
235 6H2 0.9039
236 S8P 0.9039
237 KLE 0.9038
238 PQM 0.9036
239 CHQ 0.9035
240 1AJ 0.9034
241 OLU 0.9034
242 H2B 0.9034
243 HBI 0.9034
244 4FC 0.9030
245 FSE 0.9030
246 A5H 0.9029
247 NU3 0.9028
248 JGY 0.9026
249 47V 0.9025
250 IQZ 0.9025
251 CX5 0.9023
252 SSY 0.9023
253 3G1 0.9023
254 AZY 0.9023
255 3G3 0.9022
256 5WW 0.9021
257 PZX 0.9021
258 LTN 0.9020
259 PQS 0.9020
260 SGW 0.9018
261 C0W 0.9018
262 EQU 0.9016
263 EST 0.9015
264 NW1 0.9014
265 BGU 0.9013
266 S7D 0.9013
267 CUE 0.9011
268 OA4 0.9010
269 40N 0.9010
270 O53 0.9009
271 COL 0.9009
272 DE7 0.9007
273 1ZC 0.9007
274 DX2 0.9005
275 CC6 0.9005
276 0K7 0.9004
277 22L 0.9003
278 6MW 0.9002
279 NRA 0.9002
280 OTA 0.9002
281 FNT 0.9002
282 7AP 0.9000
283 AUV 0.8998
284 IDD 0.8997
285 AOY 0.8997
286 4AB 0.8996
287 4K2 0.8995
288 IPJ 0.8995
289 H0V 0.8991
290 39Z 0.8990
291 F18 0.8990
292 ZEZ 0.8989
293 ZIP 0.8987
294 AXX 0.8987
295 G14 0.8987
296 1EL 0.8987
297 OPA 0.8987
298 801 0.8986
299 121 0.8986
300 0QV 0.8986
301 FHI 0.8986
302 0ON 0.8985
303 5I5 0.8982
304 Q8G 0.8981
305 B4L 0.8981
306 3D1 0.8981
307 3CA 0.8980
308 THM 0.8980
309 YE6 0.8979
310 QKU 0.8978
311 0MB 0.8978
312 5F5 0.8977
313 VM1 0.8976
314 RKV 0.8974
315 51Y 0.8973
316 HWH 0.8972
317 XYS XYS 0.8971
318 DQH 0.8971
319 DH2 0.8971
320 120 0.8970
321 CC5 0.8969
322 4Z1 0.8969
323 XIF XYP 0.8969
324 LJ3 0.8969
325 XYP XIF 0.8969
326 NK5 0.8968
327 G30 0.8967
328 ZZA 0.8965
329 XCG 0.8964
330 KW7 0.8961
331 TCR 0.8960
332 15Q 0.8959
333 5SJ 0.8958
334 BMZ 0.8958
335 122 0.8958
336 YZ9 0.8958
337 3QI 0.8957
338 2UD 0.8955
339 LZ5 0.8954
340 M77 0.8952
341 1XS 0.8951
342 EES 0.8951
343 1DR 0.8951
344 5WK 0.8951
345 5DE 0.8950
346 848 0.8950
347 EI1 0.8950
348 WCU 0.8949
349 B7H 0.8949
350 CUH 0.8948
351 5WT 0.8947
352 DBE 0.8947
353 4AF 0.8946
354 3IL 0.8944
355 S0D 0.8943
356 1FL 0.8943
357 PRL 0.8942
358 KF5 0.8941
359 XYP XDN 0.8940
360 ZTW 0.8940
361 NXB 0.8940
362 K48 0.8939
363 WV7 0.8938
364 K7H 0.8938
365 28B 0.8938
366 XDN XYP 0.8938
367 2WU 0.8935
368 U4J 0.8934
369 WG8 0.8933
370 AUY 0.8931
371 8D6 0.8927
372 WVV 0.8926
373 TPM 0.8925
374 108 0.8925
375 NVS 0.8924
376 RKY 0.8924
377 49P 0.8924
378 5WN 0.8923
379 WA2 0.8923
380 8HH 0.8922
381 HMO 0.8921
382 AJ6 0.8921
383 F5C 0.8921
384 ZEA 0.8920
385 SNV 0.8920
386 HPX 0.8919
387 SWX 0.8919
388 V2Z 0.8919
389 UN4 0.8918
390 QC1 0.8918
391 S98 0.8917
392 AQN 0.8917
393 3Y7 0.8917
394 1SF 0.8916
395 Q92 0.8916
396 BIE 0.8916
397 WA1 0.8914
398 MQR 0.8914
399 MBP 0.8913
400 U14 0.8912
401 C0V 0.8911
402 7QY 0.8911
403 3UG 0.8910
404 SU9 0.8910
405 LR8 0.8909
406 KU1 0.8908
407 M3F 0.8907
408 X48 0.8907
409 SAK 0.8906
410 HRD 0.8906
411 STZ 0.8905
412 YX1 0.8905
413 IK1 0.8904
414 338 0.8904
415 5C1 0.8903
416 CX4 0.8902
417 TI7 0.8901
418 NFZ 0.8901
419 42R 0.8900
420 245 0.8900
421 J84 0.8900
422 EAT 0.8899
423 KXN 0.8898
424 5XL 0.8898
425 TID 0.8897
426 VC3 0.8897
427 0NJ 0.8897
428 5AD 0.8896
429 5E1 0.8895
430 2GD 0.8894
431 TMG 0.8894
432 NPZ 0.8892
433 L07 0.8892
434 BRY 0.8890
435 5OR 0.8890
436 J3Z 0.8889
437 X8I 0.8888
438 HUL 0.8887
439 BP7 0.8886
440 CR4 0.8886
441 S60 0.8885
442 6SD 0.8885
443 789 0.8885
444 Y70 0.8884
445 FHV 0.8883
446 AJG 0.8883
447 ASE 0.8882
448 XDL XYP 0.8882
449 J38 0.8882
450 OUG 0.8880
451 2PV 0.8880
452 XIL 0.8879
453 OUA 0.8879
454 HWB 0.8877
455 Q8D 0.8876
456 LUM 0.8876
457 CG 0.8876
458 DX7 0.8875
459 TYP 0.8872
460 205 0.8871
461 12R 0.8870
462 NOC 0.8870
463 ARJ 0.8870
464 LRW 0.8869
465 J8D 0.8869
466 LJ4 0.8869
467 6EL 0.8867
468 Y3L 0.8867
469 6DE 0.8867
470 EVO 0.8866
471 3WJ 0.8865
472 536 0.8865
473 3IP 0.8863
474 XYS AZI XYS 0.8863
475 0OP 0.8863
476 9FH 0.8860
477 26C 0.8860
478 MRI 0.8859
479 AV6 0.8858
480 BXZ 0.8858
481 F36 0.8857
482 5E2 0.8857
483 XYS XYP 0.8857
484 GZV 0.8856
485 697 0.8856
486 AJD 0.8855
487 0H5 0.8855
488 69W 0.8855
489 NE2 0.8854
490 3C5 0.8853
491 72D 0.8852
492 IMK 0.8851
493 KOM 0.8850
494 DHC 0.8849
495 397 0.8849
496 39R 0.8849
497 DBS 0.8848
498 AKD 0.8848
499 B61 0.8847
500 2LT 0.8847
501 STV 0.8847
502 OSY 0.8847
503 JF8 0.8846
504 U13 0.8844
505 7G1 0.8844
506 BHS 0.8843
507 2M7 0.8841
508 1EB 0.8840
509 EQW 0.8839
510 LEL 0.8838
511 6VW 0.8837
512 4YE 0.8837
513 MMJ 0.8837
514 3CX 0.8837
515 TVC 0.8835
516 RF2 0.8834
517 MW5 0.8833
518 P9I 0.8831
519 11X 0.8830
520 4MP 0.8829
521 R4E 0.8827
522 TQ3 0.8826
523 LFQ 0.8826
524 MR6 0.8825
525 6B5 0.8825
526 1ER 0.8824
527 WST 0.8824
528 FER 0.8823
529 TCC 0.8822
530 ZHA 0.8821
531 ODK 0.8819
532 AMR 0.8818
533 TJM 0.8818
534 4BX 0.8818
535 L15 0.8816
536 GB4 0.8815
537 GA2 0.8814
538 PMP 0.8814
539 F4U 0.8813
540 4FE 0.8813
541 MUX 0.8813
542 1UT 0.8813
543 X6W 0.8813
544 XI7 0.8812
545 1YO 0.8811
546 AUE 0.8811
547 A64 0.8809
548 FL8 0.8809
549 MUR 0.8807
550 JCQ 0.8807
551 DAH 0.8806
552 JBZ 0.8805
553 FBC 0.8805
554 NDD 0.8805
555 BQ2 0.8804
556 LP8 0.8803
557 38E 0.8803
558 1V0 0.8803
559 D87 0.8803
560 PCQ 0.8803
561 CUQ 0.8802
562 TES 0.8802
563 6FB 0.8802
564 6JP 0.8801
565 3TI 0.8799
566 GHQ 0.8799
567 4UM 0.8798
568 A05 0.8797
569 JVD 0.8795
570 HO6 0.8794
571 PLP 0.8794
572 MIL 0.8794
573 EWG 0.8793
574 244 0.8792
575 6J5 0.8792
576 4EU 0.8790
577 BVS 0.8790
578 PZ8 0.8790
579 M78 0.8787
580 U12 0.8787
581 18E 0.8786
582 QR2 0.8786
583 SVG 0.8784
584 TEF 0.8784
585 BX4 0.8783
586 XZ1 0.8783
587 NEO 0.8782
588 IXM 0.8782
589 MD6 0.8779
590 MR4 0.8779
591 A7Q 0.8779
592 4I8 0.8778
593 GNR 0.8778
594 GJK 0.8777
595 NWD 0.8777
596 C09 0.8775
597 54E 0.8774
598 RCV 0.8774
599 9XZ 0.8773
600 613 0.8772
601 UN9 0.8772
602 5TT 0.8771
603 KLV 0.8771
604 5P7 0.8771
605 AWE 0.8770
606 PTB 0.8769
607 IRH 0.8768
608 AUG 0.8767
609 3VS 0.8765
610 PUE 0.8763
611 3L1 0.8763
612 MR5 0.8762
613 4F8 0.8761
614 B2L 0.8760
615 1QV 0.8760
616 2PK 0.8760
617 ITE 0.8759
618 D4O 0.8758
619 7FU 0.8757
620 QIV 0.8757
621 7N8 0.8756
622 LJ1 0.8756
623 NAG 0.8755
624 BZQ 0.8755
625 VUP 0.8755
626 27M 0.8753
627 S45 0.8752
628 5TU 0.8752
629 MXD 0.8751
630 4P9 0.8751
631 BUX 0.8751
632 DX8 0.8751
633 KYN 0.8751
634 LZ4 0.8749
635 XYP XYS 0.8748
636 ECS 0.8748
637 A51 0.8748
638 MQS 0.8748
639 0DJ 0.8748
640 XG1 0.8747
641 A9E 0.8747
642 35K 0.8747
643 CFK 0.8747
644 2GE 0.8746
645 2L2 0.8746
646 U7E 0.8745
647 ESL 0.8745
648 9KZ 0.8745
649 LOX XYP 0.8744
650 BG8 0.8744
651 LC1 0.8744
652 9OF 0.8744
653 MYU 0.8743
654 B2E 0.8742
655 T21 0.8742
656 EUH 0.8742
657 XYP XIM 0.8741
658 6WU 0.8741
659 0X2 0.8738
660 2AN 0.8738
661 5R9 0.8737
662 N1E 0.8737
663 FCD 0.8737
664 D9Z 0.8737
665 PE2 0.8735
666 7EL 0.8734
667 BA5 0.8734
668 124 0.8734
669 ESR 0.8733
670 5BX 0.8733
671 3VX 0.8732
672 ESZ 0.8731
673 2FX 0.8731
674 8SK 0.8731
675 Q11 0.8731
676 I0G 0.8731
677 78U 0.8725
678 17M 0.8725
679 FZM 0.8724
680 ERZ 0.8723
681 1OT 0.8723
682 LJ2 0.8722
683 FF2 0.8720
684 90G 0.8718
685 G6P 0.8718
686 AJ1 0.8717
687 U55 0.8717
688 4YF 0.8716
689 JVB 0.8715
690 TVZ 0.8715
691 LZ7 0.8715
692 HRM 0.8714
693 PXP 0.8714
694 D5F 0.8714
695 E42 0.8713
696 S0J 0.8712
697 5H6 0.8711
698 SYE 0.8711
699 D1Y 0.8711
700 JTF 0.8709
701 AQ1 0.8708
702 90M 0.8708
703 5OO 0.8708
704 9NB 0.8707
705 D4X 0.8707
706 2AX 0.8706
707 MI2 0.8706
708 CNI 0.8705
709 9ME 0.8704
710 ADN 0.8704
711 E92 0.8702
712 MEX 0.8702
713 X0T 0.8702
714 8V8 0.8702
715 DHT 0.8701
716 MYC 0.8700
717 9FG 0.8698
718 X04 0.8697
719 20N 0.8694
720 UQ1 0.8693
721 60L 0.8693
722 NE1 0.8692
723 3C3 0.8691
724 UL1 0.8691
725 5WM 0.8691
726 FTK 0.8688
727 2OX 0.8688
728 IW1 0.8687
729 PLR 0.8685
730 JRO 0.8682
731 5SD 0.8682
732 83D 0.8681
733 BG6 0.8680
734 GO2 0.8679
735 JTA 0.8677
736 A5Q 0.8676
737 SDN 0.8675
738 BXS 0.8674
739 1A5 0.8673
740 6ZW 0.8673
741 5DN 0.8672
742 PMM 0.8672
743 657 0.8671
744 HNT 0.8670
745 2LW 0.8670
746 1Q1 0.8670
747 68C 0.8670
748 MFR 0.8670
749 GNG 0.8669
750 B41 0.8668
751 9UL 0.8666
752 B21 0.8665
753 FC2 0.8665
754 RDM 0.8665
755 WS7 0.8664
756 FZB 0.8663
757 AC2 0.8663
758 T98 0.8659
759 5KN 0.8658
760 S62 0.8657
761 J8G 0.8655
762 IBP 0.8653
763 VGS 0.8652
764 1YL 0.8651
765 IEE 0.8650
766 AD6 0.8650
767 AHR AHR 0.8650
768 S7V 0.8650
769 0RY 0.8650
770 0QA 0.8650
771 GF7 0.8649
772 YEX 0.8649
773 D1G 0.8649
774 FX5 0.8649
775 AX1 0.8648
776 23M 0.8647
777 N91 0.8647
778 0OY 0.8647
779 3D3 0.8644
780 DBQ 0.8644
781 CJZ 0.8643
782 NPS 0.8642
783 TB8 0.8642
784 NQ8 0.8641
785 88X 0.8641
786 7ZL 0.8640
787 BSU 0.8639
788 E98 0.8639
789 SJR 0.8639
790 BBP 0.8638
791 BNY 0.8635
792 SJK 0.8635
793 0LA 0.8634
794 KMY 0.8633
795 Z21 0.8633
796 ASD 0.8633
797 72E 0.8633
798 KLS 0.8633
799 IS2 0.8632
800 JGB 0.8632
801 4HG 0.8631
802 BGK 0.8631
803 VFM 0.8629
804 FZ0 0.8629
805 X6P 0.8628
806 26A 0.8628
807 MT6 0.8628
808 SOJ 0.8624
809 M9N 0.8624
810 6WL 0.8623
811 6HP 0.8622
812 8BD 0.8622
813 RKN 0.8620
814 54X 0.8620
815 9X3 0.8620
816 3RH 0.8619
817 L02 0.8618
818 G1L 0.8617
819 3Q0 0.8612
820 E9S 0.8610
821 DTQ 0.8609
822 IRG 0.8608
823 LOT 0.8608
824 C53 0.8608
825 CZ0 0.8607
826 96R 0.8607
827 QNM 0.8603
828 1UR 0.8603
829 14W 0.8600
830 OAI 0.8600
831 53X 0.8599
832 W23 0.8599
833 LJ5 0.8598
834 MHD GAL 0.8595
835 6EN 0.8595
836 E1K 0.8593
837 7A9 0.8593
838 IIH 0.8591
839 56N 0.8588
840 RFZ 0.8585
841 K80 0.8584
842 B23 0.8583
843 0XR 0.8582
844 5E4 0.8579
845 ML1 0.8577
846 2XY 0.8577
847 GNJ 0.8575
848 555 0.8573
849 K0G 0.8571
850 TR4 0.8571
851 AIQ 0.8570
852 KWV 0.8565
853 ID8 0.8563
854 BGP 0.8563
855 ALA PHE 0.8560
856 80G 0.8560
857 GXD 0.8560
858 LVE 0.8560
859 S46 0.8558
860 AOM 0.8558
861 1Q2 0.8555
862 6J3 0.8550
863 37E 0.8549
864 T5J 0.8549
865 5RP 0.8544
866 AOX 0.8542
867 BHF 0.8538
868 8HG 0.8538
869 21E 0.8537
870 5XM 0.8537
871 EZL 0.8537
872 Q9T 0.8526
873 X29 0.8525
874 GLP 0.8519
875 HHS 0.8519
876 M16 0.8518
877 38B 0.8516
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3L5R; Ligand: 47X; 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: 3l5r.bio1) has 79 residues
No: Leader PDB Ligand Sequence Similarity
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