Receptor
PDB id Resolution Class Description Source Keywords
2ay5 2.4 Å EC: 2.6.1.57 AROMATIC AMINO ACID AMINOTRANSFERASE WITH 3-INDOLEPROPIONIC PARACOCCUS DENITRIFICANS AMINOTRANSFERASE
Ref.: THE ACTIVE SITE OF PARACOCCUS DENITRIFICANS AROMATI ACID AMINOTRANSFERASE HAS CONTRARY PROPERTIES: FLEX AND RIGIDITY. BIOCHEMISTRY V. 38 1176 1999
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
IOP B:414;
Valid;
none;
Kd = 2.6 mM
189.211 C11 H11 N O2 c1ccc...
PLP A:413;
B:413;
Invalid;
Invalid;
none;
none;
submit data
247.142 C8 H10 N O6 P Cc1c(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2AY3 2.4 Å EC: 2.6.1.57 AROMATIC AMINO ACID AMINOTRANSFERASE WITH 3-(3,4-DIMETHOXYPH PROPIONIC ACID PARACOCCUS DENITRIFICANS AMINOTRANSFERASE
Ref.: THE ACTIVE SITE OF PARACOCCUS DENITRIFICANS AROMATI ACID AMINOTRANSFERASE HAS CONTRARY PROPERTIES: FLEX AND RIGIDITY. BIOCHEMISTRY V. 38 1176 1999
Members (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2AY8 Kd = 5.8 mM 4TB C8 H10 O2 S c1cc(sc1)C....
2 2AY4 Kd = 1.24 mM PPT C10 H12 O2 Cc1ccc(cc1....
3 2AY7 Kd = 5 mM CLT C10 H12 O2 c1ccc(cc1)....
4 2AY3 Kd = 0.28 mM MPP C11 H14 O4 COc1ccc(cc....
5 1AY8 - HCI C9 H10 O2 c1ccc(cc1)....
6 1AY5 - MAE C4 H4 O4 C(=C/C(=O)....
7 2AY9 Kd = 6.9 mM 5PV C11 H14 O2 c1ccc(cc1)....
8 2AY6 Kd = 0.78 mM 3IB C12 H13 N O2 c1ccc2c(c1....
9 2AY2 Kd = 13.1 mM CXP C9 H16 O2 C1CCC(CC1)....
10 2AY5 Kd = 2.6 mM IOP C11 H11 N O2 c1ccc2c(c1....
11 2AY1 Kd = 5.14 mM AHC C9 H11 N O2 c1cc(ccc1C....
70% Homology Family (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2AY8 Kd = 5.8 mM 4TB C8 H10 O2 S c1cc(sc1)C....
2 2AY4 Kd = 1.24 mM PPT C10 H12 O2 Cc1ccc(cc1....
3 2AY7 Kd = 5 mM CLT C10 H12 O2 c1ccc(cc1)....
4 2AY3 Kd = 0.28 mM MPP C11 H14 O4 COc1ccc(cc....
5 1AY8 - HCI C9 H10 O2 c1ccc(cc1)....
6 1AY5 - MAE C4 H4 O4 C(=C/C(=O)....
7 2AY9 Kd = 6.9 mM 5PV C11 H14 O2 c1ccc(cc1)....
8 2AY6 Kd = 0.78 mM 3IB C12 H13 N O2 c1ccc2c(c1....
9 2AY2 Kd = 13.1 mM CXP C9 H16 O2 C1CCC(CC1)....
10 2AY5 Kd = 2.6 mM IOP C11 H11 N O2 c1ccc2c(c1....
11 2AY1 Kd = 5.14 mM AHC C9 H11 N O2 c1cc(ccc1C....
50% Homology Family (72)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2AY8 Kd = 5.8 mM 4TB C8 H10 O2 S c1cc(sc1)C....
2 2AY4 Kd = 1.24 mM PPT C10 H12 O2 Cc1ccc(cc1....
3 2AY7 Kd = 5 mM CLT C10 H12 O2 c1ccc(cc1)....
4 2AY3 Kd = 0.28 mM MPP C11 H14 O4 COc1ccc(cc....
5 1AY8 - HCI C9 H10 O2 c1ccc(cc1)....
6 1AY5 - MAE C4 H4 O4 C(=C/C(=O)....
7 2AY9 Kd = 6.9 mM 5PV C11 H14 O2 c1ccc(cc1)....
8 2AY6 Kd = 0.78 mM 3IB C12 H13 N O2 c1ccc2c(c1....
9 2AY2 Kd = 13.1 mM CXP C9 H16 O2 C1CCC(CC1)....
10 2AY5 Kd = 2.6 mM IOP C11 H11 N O2 c1ccc2c(c1....
11 2AY1 Kd = 5.14 mM AHC C9 H11 N O2 c1cc(ccc1C....
12 1X2A - PDG C13 H19 N2 O9 P Cc1c(c(c(c....
13 1CZE Kd = 2.4 mM SIN C4 H6 O4 C(CC(=O)O)....
14 1AHX Kd = 120 uM HCI C9 H10 O2 c1ccc(cc1)....
15 3PAA - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
16 3QPG - 3QP C13 H16 N O9 P Cc1ccc(c(c....
17 1QIT - MAE C4 H4 O4 C(=C/C(=O)....
18 2QBT - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
19 1TOI Kd = 0.09 mM HCI C9 H10 O2 c1ccc(cc1)....
20 1ASC - NPL C9 H16 N2 O5 P Cc1c(c(c(c....
21 1ASA - MAE C4 H4 O4 C(=C/C(=O)....
22 1ARH - PPD C12 H17 N2 O9 P Cc1c(c(c(c....
23 1CZC Kd = 1.5 mM GUA C5 H8 O4 C(CC(=O)O)....
24 1X29 - PMG C14 H21 N2 O9 P Cc1c(c(c(c....
25 1QIS - MAE C4 H4 O4 C(=C/C(=O)....
26 1AMQ - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
27 4A00 - PP3 C11 H17 N2 O7 P Cc1c(c(c(c....
28 1IX7 - MAE C4 H4 O4 C(=C/C(=O)....
29 1AMR - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
30 1TOK Kd = 3.4 mM MAE C4 H4 O4 C(=C/C(=O)....
31 1ASM - MAE C4 H4 O4 C(=C/C(=O)....
32 5VWQ - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
33 1AHG - TYR PLP n/a n/a
34 5VWR - PL6 C13 H17 N2 O9 P Cc1c(c(c(c....
35 1AHF - IOP C11 H11 N O2 c1ccc2c(c1....
36 2QB2 - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
37 3ZZK - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
38 3PA9 - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
39 1B4X - MAE C4 H4 O4 C(=C/C(=O)....
40 1X28 - PGU C13 H19 N2 O9 P Cc1c(c(c(c....
41 1YOO - IVA C5 H10 O2 CC(C)CC(=O....
42 1TOJ Kd = 0.41 mM HCI C9 H10 O2 c1ccc(cc1)....
43 1SPA - NPL C9 H16 N2 O5 P Cc1c(c(c(c....
44 2Q7W - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
45 1TOG Kd = 0.6 mM HCI C9 H10 O2 c1ccc(cc1)....
46 4DBC - 3QP C13 H16 N O9 P Cc1ccc(c(c....
47 1AIA - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
48 1ART - PLP 0A0 n/a n/a
49 1CQ7 - PY5 C13 H21 N2 O7 P CCC[C@@H](....
50 1ASD - MAE C4 H4 O4 C(=C/C(=O)....
51 1C9C - PP3 C11 H17 N2 O7 P Cc1c(c(c(c....
52 1CQ8 - PY6 C14 H23 N2 O7 P CCCC[C@@H]....
53 2QA3 - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
54 1QIR - MAE C4 H4 O4 C(=C/C(=O)....
55 1ARG - PPD C12 H17 N2 O9 P Cc1c(c(c(c....
56 1AIC - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
57 1AHY Kd = 440 uM MAE C4 H4 O4 C(=C/C(=O)....
58 2QB3 - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
59 1MAP - KET C12 H16 N2 O9 P Cc1c(c(c(c....
60 1AKC - PPE C13 H20 N2 O9 P Cc1c(c(c(c....
61 1AMA - PLA C13 H19 N2 O9 P Cc1c(c(c(c....
62 1AKB - PPD C12 H17 N2 O9 P Cc1c(c(c(c....
63 1IVR - CBA C12 H17 N2 O11 P Cc1c(c(c(c....
64 1AKA - PLP C8 H10 N O6 P Cc1c(c(c(c....
65 1MAQ - PGU C13 H19 N2 O9 P Cc1c(c(c(c....
66 9AAT - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
67 1OXP - IK2 C10 H15 N2 O8 P Cc1c(c(c(c....
68 1OXO - IK2 C10 H15 N2 O8 P Cc1c(c(c(c....
69 4RKC - PMP C8 H13 N2 O5 P Cc1c(c(c(c....
70 2CST - MAE C4 H4 O4 C(=C/C(=O)....
71 1YAA - MAE C4 H4 O4 C(=C/C(=O)....
72 6DND - PLP C8 H10 N O6 P Cc1c(c(c(c....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: IOP; Similar ligands found: 18
No: Ligand ECFP6 Tc MDL keys Tc
1 IOP 1 1
2 3IB 0.76087 0.965517
3 9BF 0.717391 0.6875
4 IAC 0.617021 0.964286
5 TSS 0.608696 0.6
6 TSR 0.541667 0.657143
7 4Z9 0.528302 0.84375
8 ITW 0.528302 0.78125
9 3IL 0.528302 0.84375
10 TRP 0.518519 0.764706
11 DTR 0.518519 0.764706
12 IAG 0.517857 0.642857
13 ZIQ 0.5 0.666667
14 ET0 0.491228 0.8
15 IAD 0.467742 0.642857
16 TR7 0.457627 0.675676
17 IAV 0.444444 0.642857
18 ICO 0.411765 0.733333
Similar Ligands (3D)
Ligand no: 1; Ligand: IOP; Similar ligands found: 1199
No: Ligand Similarity coefficient
1 LTN 0.9826
2 I2E 0.9738
3 8XL 0.9650
4 9F8 0.9649
5 5WN 0.9644
6 3EB 0.9639
7 EYY 0.9636
8 4OG 0.9631
9 EXR 0.9625
10 C0W 0.9581
11 FER 0.9525
12 C4E 0.9513
13 EXL 0.9512
14 XEN 0.9501
15 DHC 0.9492
16 CTE 0.9483
17 MD6 0.9479
18 ZON 0.9475
19 2GQ 0.9468
20 FWD 0.9468
21 ARP 0.9462
22 ZIP 0.9457
23 2FX 0.9456
24 ALN 0.9452
25 DTE 0.9451
26 LL1 0.9448
27 GJK 0.9445
28 96Z 0.9444
29 FT6 0.9439
30 363 0.9428
31 NAL 0.9427
32 IOS 0.9421
33 B41 0.9418
34 RVE 0.9417
35 BB4 0.9416
36 3SU 0.9413
37 F40 0.9412
38 QIV 0.9407
39 NVU 0.9407
40 CWD 0.9401
41 QUB 0.9398
42 APS 0.9397
43 78U 0.9389
44 S7G 0.9384
45 JCZ 0.9383
46 1QP 0.9377
47 MQB 0.9376
48 H35 0.9372
49 AMR 0.9367
50 NIY 0.9364
51 GO2 0.9362
52 EYJ 0.9361
53 BWD 0.9361
54 5B2 0.9352
55 0LH 0.9347
56 M5H 0.9341
57 1FE 0.9335
58 5TO 0.9334
59 M3Q 0.9334
60 TCR 0.9333
61 6C8 0.9331
62 ZEA 0.9328
63 SRO 0.9324
64 2UD 0.9322
65 EVF 0.9321
66 ZHA 0.9320
67 G6P 0.9320
68 HWH 0.9319
69 3VX 0.9316
70 EQA 0.9316
71 YOF 0.9316
72 DAH 0.9316
73 LR2 0.9313
74 C9M 0.9312
75 2HC 0.9312
76 SKF 0.9308
77 6C5 0.9307
78 NFZ 0.9306
79 JXK 0.9297
80 KYN 0.9296
81 52F 0.9293
82 IWD 0.9293
83 PHE 0.9292
84 QBM 0.9281
85 YE7 0.9281
86 5E5 0.9280
87 LSQ 0.9280
88 2KU 0.9278
89 EV3 0.9277
90 P7Y 0.9277
91 AZY 0.9276
92 VM1 0.9275
93 Y3L 0.9272
94 BQ2 0.9270
95 833 0.9268
96 MMS 0.9266
97 2JX 0.9265
98 7L4 0.9265
99 CX4 0.9264
100 S24 0.9264
101 QH3 0.9262
102 HWD 0.9260
103 N7I 0.9260
104 P80 0.9260
105 YF3 0.9259
106 4BX 0.9258
107 N91 0.9257
108 AC2 0.9257
109 F5C 0.9256
110 6HP 0.9255
111 P4L 0.9254
112 SYE 0.9253
113 MP5 0.9252
114 XI7 0.9252
115 JY2 0.9252
116 6N4 0.9248
117 TMG 0.9248
118 BG6 0.9246
119 JYT 0.9245
120 MAJ 0.9245
121 4I8 0.9244
122 HC4 0.9243
123 3D3 0.9241
124 3D8 0.9238
125 BK9 0.9238
126 TOH 0.9237
127 NFM 0.9236
128 5V7 0.9231
129 2P3 0.9230
130 GO8 0.9229
131 PIQ 0.9228
132 9JT 0.9227
133 DXK 0.9227
134 61M 0.9226
135 4FE 0.9223
136 ALE 0.9222
137 XDE 0.9222
138 F52 0.9221
139 I59 0.9220
140 0JD 0.9220
141 RCV 0.9219
142 DHY 0.9217
143 92P 0.9217
144 B5A 0.9216
145 JXT 0.9216
146 0UL 0.9214
147 6FG 0.9208
148 CIY 0.9208
149 KWB 0.9207
150 5F5 0.9206
151 LRW 0.9206
152 GJP 0.9205
153 M4E 0.9202
154 JYK 0.9201
155 AVA 0.9201
156 1V3 0.9201
157 0DF 0.9198
158 5NN 0.9195
159 M78 0.9193
160 N1E 0.9193
161 4R1 0.9191
162 RSV 0.9187
163 ASE 0.9187
164 EYV 0.9186
165 F06 0.9184
166 SBK 0.9180
167 PLP 0.9178
168 FF2 0.9178
169 ZEZ 0.9177
170 4ZD 0.9177
171 EYM 0.9177
172 ZYQ 0.9176
173 A6W 0.9176
174 MPP 0.9176
175 PLR 0.9176
176 0FR 0.9175
177 6C9 0.9174
178 WA2 0.9174
179 5F8 0.9173
180 36M 0.9173
181 QUS 0.9172
182 67Y 0.9171
183 5ER 0.9166
184 P93 0.9163
185 6FB 0.9162
186 28S 0.9160
187 KF5 0.9159
188 8RK 0.9158
189 GLP 0.9156
190 MJ5 0.9155
191 IYR 0.9153
192 57O 0.9152
193 2D2 0.9149
194 14W 0.9148
195 M9N 0.9147
196 4FF 0.9146
197 JHY 0.9145
198 FNA 0.9145
199 OMD 0.9145
200 HQ9 0.9145
201 ZEC 0.9145
202 XCG 0.9144
203 3C4 0.9144
204 X04 0.9144
205 6DQ 0.9142
206 0SY 0.9140
207 TU0 0.9140
208 EV2 0.9140
209 AAN 0.9137
210 EWG 0.9136
211 SQV 0.9135
212 5WU 0.9135
213 Q5M 0.9134
214 NLA 0.9133
215 9ZE 0.9133
216 HA6 0.9132
217 YIP 0.9128
218 CFA 0.9127
219 1F1 0.9127
220 ESP 0.9127
221 X0U 0.9125
222 JYW 0.9123
223 1Q4 0.9123
224 7I2 0.9123
225 NPA 0.9122
226 ESX 0.9122
227 JAW 0.9122
228 428 0.9120
229 3ZB 0.9120
230 HPP 0.9119
231 JDN 0.9118
232 LEL 0.9116
233 2LT 0.9116
234 9UL 0.9114
235 NWD 0.9112
236 HPT 0.9111
237 5OO 0.9110
238 F4E 0.9110
239 3XH 0.9109
240 A5H 0.9108
241 II4 0.9108
242 15N 0.9108
243 AHC 0.9105
244 1V4 0.9105
245 C9E 0.9105
246 3TC 0.9104
247 PPT 0.9103
248 QMS 0.9103
249 MJW 0.9100
250 EXD 0.9100
251 7MX 0.9098
252 3GX 0.9097
253 MNP 0.9097
254 FPL 0.9096
255 HH6 0.9095
256 7EH 0.9095
257 2C2 0.9095
258 JB8 0.9093
259 HA5 0.9092
260 HRM 0.9091
261 EXG 0.9090
262 5FL 0.9090
263 5TZ 0.9089
264 H4B 0.9089
265 A73 0.9088
266 GB4 0.9087
267 ETV 0.9087
268 790 0.9084
269 S8D 0.9083
270 JPQ 0.9083
271 OIA 0.9083
272 6DP 0.9082
273 LNR 0.9082
274 0HO 0.9082
275 6FZ 0.9081
276 TB8 0.9078
277 Q0K 0.9078
278 BY5 0.9078
279 4Z1 0.9076
280 7O4 0.9075
281 3IP 0.9075
282 KP2 0.9075
283 AJG 0.9075
284 6NT 0.9075
285 848 0.9074
286 DEZ 0.9073
287 AVO 0.9073
288 5VU 0.9072
289 JGY 0.9071
290 0HN 0.9070
291 PXP 0.9069
292 RNO 0.9068
293 NKI 0.9067
294 4BY 0.9066
295 55D 0.9065
296 49P 0.9064
297 PMP 0.9064
298 1V1 0.9064
299 YIH 0.9062
300 5O5 0.9062
301 X48 0.9062
302 S0E 0.9062
303 KTW 0.9060
304 RDV 0.9059
305 68A 0.9057
306 2QU 0.9056
307 STV 0.9054
308 2LY 0.9053
309 6C4 0.9052
310 MFZ 0.9051
311 FCD 0.9051
312 27K 0.9050
313 S0W 0.9050
314 HJH 0.9050
315 EUH 0.9049
316 6J5 0.9049
317 0ON 0.9048
318 FCW 0.9048
319 WLH 0.9048
320 AVX 0.9047
321 P9E 0.9047
322 CH9 0.9046
323 YE6 0.9045
324 PPY 0.9045
325 GZV 0.9043
326 G14 0.9043
327 J4K 0.9042
328 S8G 0.9040
329 X2M 0.9039
330 2QV 0.9038
331 QIF 0.9036
332 25F 0.9036
333 BCU 0.9035
334 C53 0.9035
335 C2Y 0.9033
336 20D 0.9033
337 PZP 0.9032
338 PLP PMP 0.9032
339 3F4 0.9032
340 SNO 0.9032
341 NK5 0.9030
342 TZM 0.9030
343 78Y 0.9030
344 4NS 0.9030
345 CLU 0.9029
346 CUT 0.9029
347 EYA 0.9028
348 SZ5 0.9028
349 L21 0.9028
350 CH8 0.9027
351 R4E 0.9026
352 ABF 0.9026
353 CC5 0.9025
354 EUE 0.9025
355 ZME 0.9023
356 A7H 0.9023
357 LVD 0.9021
358 4YZ 0.9021
359 GC3 0.9021
360 6HO 0.9021
361 P81 0.9020
362 263 0.9020
363 PPN 0.9018
364 ZRK 0.9017
365 TYR 0.9016
366 22L 0.9016
367 3A9 0.9016
368 GA2 0.9015
369 PQT 0.9015
370 ZZA 0.9013
371 1PS 0.9013
372 O2Y 0.9013
373 657 0.9012
374 BSA 0.9012
375 OW7 0.9011
376 JXQ 0.9010
377 ODK 0.9010
378 NQ7 0.9010
379 A6P 0.9009
380 N2M 0.9009
381 HLP 0.9008
382 TRF 0.9006
383 2SX 0.9006
384 JBZ 0.9005
385 092 0.9005
386 RD4 0.9004
387 0LO 0.9004
388 BVS 0.9004
389 TXW 0.9004
390 DDU 0.9004
391 E7S 0.9004
392 DDC 0.9003
393 4ZF 0.9002
394 NQH 0.9002
395 0A1 0.9002
396 SAF 0.9001
397 3HP 0.9001
398 ICB 0.9001
399 4NP 0.9001
400 8YH 0.9000
401 2LW 0.9000
402 3VQ 0.9000
403 RGK 0.9000
404 M6Z 0.9000
405 S8P 0.8999
406 8U3 0.8999
407 8D6 0.8998
408 2O6 0.8996
409 EY7 0.8995
410 6MW 0.8995
411 DPN 0.8995
412 AP6 0.8993
413 D8Q 0.8993
414 A3M 0.8993
415 UNJ 0.8993
416 CS2 0.8993
417 MBP 0.8992
418 TOM 0.8992
419 GXG 0.8992
420 AOY 0.8991
421 S0D 0.8991
422 3LJ 0.8988
423 LDP 0.8986
424 S7S 0.8985
425 OSB 0.8985
426 NHG 0.8985
427 NLQ 0.8985
428 5OF 0.8984
429 5H6 0.8983
430 8ZE 0.8983
431 U7E 0.8981
432 J6W 0.8981
433 27B 0.8981
434 4XF 0.8978
435 DEW 0.8978
436 1L5 0.8978
437 Q4G 0.8977
438 BRH 0.8977
439 4CN 0.8974
440 4GP 0.8973
441 5WT 0.8973
442 KYA 0.8973
443 5WM 0.8972
444 6Q3 0.8972
445 9FE 0.8972
446 2ZM 0.8971
447 47V 0.8970
448 DFL 0.8968
449 NAG 0.8968
450 TYE 0.8968
451 11X 0.8966
452 1VK 0.8966
453 PBN 0.8965
454 1AJ 0.8964
455 0XR 0.8962
456 KLS 0.8962
457 6KT 0.8962
458 V1T 0.8961
459 1A7 0.8961
460 1QV 0.8960
461 TYC 0.8960
462 KMY 0.8960
463 9KH 0.8959
464 VXX 0.8959
465 JMG 0.8958
466 THM 0.8958
467 GHQ 0.8958
468 HJ7 0.8957
469 QR2 0.8956
470 M02 0.8956
471 TLM 0.8956
472 8GK 0.8956
473 JF5 0.8955
474 PRO GLY 0.8954
475 HBO 0.8953
476 BP7 0.8953
477 327 0.8953
478 4AU 0.8953
479 0QA 0.8952
480 B23 0.8952
481 BIO 0.8952
482 SY4 0.8951
483 F90 0.8948
484 8NB 0.8947
485 HSX 0.8946
486 JXW 0.8946
487 S7A 0.8946
488 C82 0.8945
489 CXH 0.8945
490 NGT 0.8945
491 L5D 0.8945
492 0OL 0.8944
493 PNP 0.8943
494 2FY 0.8943
495 54X 0.8943
496 6J9 0.8943
497 JXZ 0.8942
498 STT 0.8942
499 D9Z 0.8941
500 1HR 0.8941
501 TA6 0.8939
502 GVY 0.8939
503 KLE 0.8937
504 9CE 0.8937
505 4BL 0.8936
506 J38 0.8936
507 7QS 0.8936
508 AJ1 0.8935
509 PO6 0.8935
510 DTY 0.8934
511 BZM 0.8934
512 3CR 0.8934
513 HCI 0.8934
514 3H2 0.8933
515 CHQ 0.8933
516 L07 0.8931
517 G1P 0.8931
518 SSY 0.8930
519 CR1 0.8930
520 F6P 0.8930
521 H75 0.8929
522 EVO 0.8928
523 BDI 0.8927
524 L12 0.8927
525 0NX 0.8927
526 1BW 0.8925
527 ZRL 0.8925
528 3VW 0.8925
529 5GT 0.8925
530 JP2 0.8924
531 4GU 0.8924
532 SXX 0.8923
533 ONZ 0.8923
534 5O6 0.8923
535 0OM 0.8923
536 EQW 0.8923
537 PW1 0.8923
538 5JT 0.8922
539 12T 0.8920
540 LZ5 0.8919
541 CPW 0.8919
542 PYU 0.8919
543 LLG 0.8917
544 8NX 0.8917
545 R8Y 0.8917
546 7Q1 0.8917
547 AZM 0.8916
548 5C1 0.8915
549 GZ2 0.8914
550 M3P 0.8914
551 OHJ 0.8913
552 795 0.8912
553 D6G 0.8912
554 92G 0.8912
555 7ZL 0.8911
556 CUH 0.8911
557 7ZC 0.8910
558 492 0.8909
559 JRB 0.8909
560 L1T 0.8909
561 5P3 0.8908
562 PH2 0.8907
563 JYE 0.8906
564 X1P 0.8905
565 BL0 0.8904
566 KDV 0.8903
567 CKU 0.8903
568 FUZ 0.8903
569 SSC 0.8903
570 OHP 0.8903
571 S3C 0.8903
572 AJD 0.8902
573 DNA 0.8902
574 7PJ 0.8901
575 IQQ 0.8901
576 3R4 0.8901
577 IDZ 0.8900
578 EMU 0.8899
579 22T 0.8899
580 5S9 0.8899
581 4G2 0.8899
582 KED 0.8899
583 D2G 0.8898
584 PE2 0.8898
585 STX 0.8898
586 HL4 0.8898
587 EGR 0.8898
588 H7Y 0.8897
589 7AP 0.8897
590 HHH 0.8896
591 DI6 0.8896
592 TCA 0.8895
593 DRG 0.8894
594 7MW 0.8894
595 ESI 0.8894
596 K82 0.8893
597 92O 0.8892
598 HXY 0.8892
599 5AD 0.8892
600 3N1 0.8892
601 JFS 0.8891
602 PVK 0.8891
603 PUE 0.8889
604 NOK 0.8889
605 NGW 0.8889
606 5NI 0.8889
607 OQC 0.8889
608 MXD 0.8888
609 SLS 0.8887
610 PVQ 0.8887
611 6NI 0.8887
612 NEO 0.8886
613 V2Z 0.8886
614 H2W 0.8885
615 FXH 0.8885
616 0K7 0.8883
617 6XC 0.8883
618 VJJ 0.8880
619 ENO 0.8879
620 ITE 0.8878
621 0OK 0.8877
622 XFE 0.8877
623 2JK 0.8877
624 0GA 0.8876
625 LI7 0.8875
626 GFP 0.8875
627 JND 0.8875
628 FZM 0.8874
629 RA7 0.8874
630 FC2 0.8874
631 5RP 0.8874
632 YTX 0.8874
633 B21 0.8874
634 ST3 0.8873
635 8CC 0.8873
636 FHV 0.8873
637 E1T 0.8872
638 4NR 0.8872
639 LGT 0.8872
640 MIL 0.8871
641 3VS 0.8871
642 DE7 0.8870
643 5GV 0.8870
644 PFF 0.8869
645 2L3 0.8869
646 PMM 0.8867
647 HMZ 0.8867
648 1SV 0.8867
649 9R5 0.8866
650 CBE 0.8866
651 F1X 0.8865
652 108 0.8865
653 5TY 0.8864
654 A5E 0.8864
655 D1Y 0.8863
656 4WF 0.8863
657 XQI 0.8862
658 BGP 0.8862
659 4MP 0.8862
660 PBA 0.8862
661 M6P 0.8862
662 2K8 0.8861
663 HHS 0.8861
664 HF2 0.8861
665 GWM 0.8861
666 CXP 0.8860
667 DCZ 0.8859
668 M6D 0.8857
669 GXD 0.8857
670 2UB 0.8857
671 Q9Z 0.8856
672 M5E 0.8856
673 JVD 0.8856
674 H2B 0.8856
675 VT3 0.8855
676 12R 0.8855
677 3D1 0.8855
678 S7D 0.8854
679 BPY 0.8854
680 4MB 0.8853
681 4HP 0.8852
682 4LV 0.8852
683 HHT 0.8850
684 0QW 0.8849
685 RES 0.8847
686 GB5 0.8847
687 ZYV 0.8846
688 4AV 0.8846
689 LP8 0.8845
690 DX5 0.8843
691 EN1 0.8843
692 GC2 0.8842
693 XJ2 0.8841
694 BZQ 0.8841
695 39Z 0.8840
696 GOE 0.8840
697 BPW 0.8839
698 0DN 0.8839
699 THA 0.8839
700 4TB 0.8838
701 RNK 0.8837
702 60L 0.8836
703 XIZ 0.8836
704 42J 0.8836
705 A5P 0.8836
706 3L1 0.8833
707 D3G 0.8832
708 A51 0.8831
709 THU 0.8831
710 MCY 0.8831
711 NBB 0.8831
712 CSN 0.8830
713 H4E 0.8830
714 JSX 0.8829
715 CDJ 0.8829
716 MUX 0.8828
717 M3W 0.8828
718 DJN 0.8828
719 535 0.8828
720 ZSP 0.8827
721 NBG 0.8827
722 R20 0.8827
723 IQW 0.8825
724 FTV 0.8825
725 3JC 0.8825
726 0FK 0.8825
727 TJM 0.8824
728 HBI 0.8824
729 XDK 0.8824
730 BC3 0.8824
731 LDC 0.8823
732 E1P 0.8823
733 89J 0.8823
734 JJQ 0.8821
735 8Y7 0.8820
736 PRL 0.8820
737 AN3 0.8820
738 ML1 0.8819
739 W8L 0.8819
740 6SD 0.8818
741 TNX 0.8818
742 BGU 0.8818
743 N2I 0.8818
744 X6P 0.8817
745 K4V 0.8816
746 6ZX 0.8816
747 3WO 0.8815
748 3WN 0.8815
749 5SJ 0.8814
750 DUR 0.8814
751 4EU 0.8814
752 8G6 0.8814
753 H7S 0.8813
754 0OO 0.8813
755 AMQ 0.8812
756 4TP 0.8812
757 ISC 0.8812
758 3RI 0.8811
759 CGW 0.8811
760 L2K 0.8810
761 SJK 0.8810
762 N9J 0.8809
763 HNM 0.8809
764 S1D 0.8808
765 4Z0 0.8808
766 MPU 0.8808
767 JVN 0.8808
768 KLV 0.8808
769 CUQ 0.8808
770 4KL 0.8808
771 OJD 0.8807
772 LIG 0.8806
773 NPL 0.8805
774 8W9 0.8804
775 1HP 0.8803
776 9FH 0.8803
777 WV7 0.8802
778 NEU 0.8801
779 57D 0.8799
780 30G 0.8796
781 272 0.8796
782 IQ5 0.8795
783 VBC 0.8795
784 9NB 0.8795
785 AEH 0.8795
786 S60 0.8794
787 ATX 0.8794
788 SLY 0.8794
789 7FU 0.8792
790 S0G 0.8792
791 CK2 0.8792
792 N4E 0.8790
793 NIF 0.8790
794 WVV 0.8790
795 XEV 0.8789
796 1XS 0.8788
797 NBV 0.8788
798 E9S 0.8787
799 OLU 0.8787
800 BBY 0.8786
801 VC3 0.8786
802 EOL 0.8786
803 GNG 0.8784
804 SDF 0.8784
805 ZYC 0.8784
806 BNX 0.8783
807 R9S 0.8783
808 ELH 0.8782
809 CX6 0.8781
810 K48 0.8781
811 FK8 0.8781
812 BZE 0.8781
813 P0P 0.8780
814 JV4 0.8780
815 B09 0.8779
816 4AB 0.8778
817 JAH 0.8778
818 LFQ 0.8777
819 MES 0.8777
820 LLT 0.8777
821 E9L 0.8776
822 M6H 0.8776
823 9KZ 0.8776
824 E4P 0.8776
825 505 0.8775
826 E9P 0.8774
827 QTG 0.8774
828 3B4 0.8773
829 B1J 0.8773
830 TZP 0.8772
831 PTB 0.8772
832 1LN 0.8772
833 ZZZ 0.8772
834 OUB 0.8772
835 3Y7 0.8770
836 XRX 0.8768
837 5LD 0.8768
838 YPN 0.8767
839 QMR 0.8767
840 069 0.8767
841 XIF XYP 0.8766
842 XYP XIF 0.8766
843 AEG 0.8766
844 9VQ 0.8765
845 3R6 0.8765
846 LO1 0.8765
847 L22 0.8764
848 RQD 0.8764
849 6ME 0.8764
850 CDY 0.8762
851 OX2 0.8761
852 HIS 0.8761
853 JF1 0.8760
854 Q02 0.8759
855 GSY 0.8759
856 HNL 0.8759
857 G30 0.8757
858 X0T 0.8757
859 IFG 0.8757
860 SU9 0.8755
861 D1G 0.8755
862 U13 0.8755
863 AHN 0.8755
864 K80 0.8754
865 5F1 0.8754
866 J0Z 0.8754
867 BHS 0.8753
868 MKN 0.8753
869 L99 0.8753
870 4ME 0.8752
871 2LP 0.8752
872 ICT 0.8752
873 2PV 0.8752
874 DY8 0.8752
875 MYI 0.8751
876 JZA 0.8751
877 ZZU 0.8750
878 F18 0.8749
879 258 0.8749
880 D87 0.8748
881 GCO 0.8748
882 GT1 0.8747
883 15A 0.8747
884 A29 0.8747
885 CCV 0.8747
886 28A 0.8746
887 9E3 0.8746
888 ZYW 0.8746
889 YZM 0.8746
890 1A5 0.8744
891 A7N 0.8743
892 EDR 0.8743
893 6L6 0.8742
894 GNW 0.8742
895 TI7 0.8742
896 774 0.8742
897 A9B 0.8741
898 FWB 0.8741
899 4LW 0.8741
900 3AK 0.8740
901 PZX 0.8739
902 HNK 0.8739
903 TL6 0.8738
904 CKA 0.8737
905 B4O 0.8737
906 1BN 0.8736
907 QME 0.8736
908 MS0 0.8735
909 50C 0.8734
910 5SP 0.8733
911 3WK 0.8733
912 ARG 0.8733
913 091 0.8731
914 8OB 0.8731
915 S8A 0.8730
916 0OY 0.8730
917 TAG 0.8730
918 NZ9 0.8730
919 DXP 0.8728
920 56D 0.8728
921 F34 0.8728
922 MUK 0.8727
923 NYL 0.8727
924 YZ9 0.8725
925 NGA 0.8725
926 B61 0.8724
927 1EB 0.8724
928 GNR 0.8724
929 6ZW 0.8723
930 1X8 0.8722
931 A7Q 0.8721
932 92K 0.8720
933 5WZ 0.8719
934 P2L 0.8719
935 NDG 0.8718
936 54F 0.8718
937 GLO 0.8718
938 8HC 0.8715
939 4BF 0.8715
940 9PL 0.8715
941 54Z 0.8714
942 6VD 0.8714
943 1OH 0.8714
944 C09 0.8713
945 5RN 0.8713
946 I3E 0.8712
947 MDR 0.8711
948 27L 0.8711
949 7N8 0.8710
950 6P3 0.8710
951 IBP 0.8710
952 S62 0.8709
953 R1P 0.8709
954 9W5 0.8709
955 OOG 0.8709
956 0W1 0.8709
957 3WL 0.8708
958 4V2 0.8708
959 AUV 0.8707
960 AS3 0.8707
961 ONR 0.8707
962 S0F 0.8706
963 536 0.8706
964 PD2 0.8706
965 UA5 0.8705
966 4Z3 0.8705
967 1ZC 0.8705
968 KP6 0.8704
969 AES 0.8704
970 HHV 0.8703
971 LWS 0.8703
972 LVP 0.8702
973 PRZ 0.8701
974 1SS 0.8701
975 D80 0.8700
976 4FP 0.8700
977 AX3 0.8700
978 MQG 0.8700
979 OTA 0.8699
980 91F 0.8698
981 7MK 0.8698
982 0OP 0.8698
983 6QT 0.8697
984 XRS 0.8697
985 PRA 0.8697
986 GZQ 0.8696
987 AXX 0.8695
988 ID2 0.8695
989 CIP 0.8695
990 LJ4 0.8695
991 5WS 0.8694
992 2PK 0.8693
993 HNT 0.8693
994 GZL 0.8693
995 JTF 0.8692
996 88L 0.8692
997 3N0 0.8692
998 GDL 0.8692
999 264 0.8691
1000 SOJ 0.8690
1001 K7H 0.8688
1002 MZM 0.8687
1003 ANF 0.8687
1004 NYJ 0.8686
1005 3XR 0.8685
1006 AKD 0.8685
1007 JR2 0.8685
1008 F4K 0.8684
1009 JF2 0.8683
1010 P7V 0.8683
1011 FQX 0.8681
1012 SYG 0.8681
1013 8OE 0.8681
1014 2UZ 0.8680
1015 D25 0.8680
1016 DX2 0.8680
1017 TL5 0.8680
1018 LR8 0.8679
1019 HX8 0.8679
1020 HIC 0.8676
1021 56N 0.8676
1022 PTS 0.8675
1023 FUD 0.8675
1024 B2E 0.8674
1025 268 0.8674
1026 ASC 0.8674
1027 0FN 0.8673
1028 CG 0.8672
1029 M4N 0.8672
1030 HFA 0.8669
1031 Z25 0.8668
1032 LIP 0.8667
1033 VFG 0.8666
1034 PH3 0.8666
1035 OA1 0.8665
1036 E35 0.8665
1037 MEX 0.8665
1038 RCM 0.8664
1039 W81 0.8664
1040 FMQ 0.8664
1041 YIE 0.8663
1042 A4V 0.8660
1043 XYH 0.8659
1044 PA5 0.8659
1045 FLC 0.8658
1046 MTL 0.8657
1047 PSJ 0.8656
1048 IQZ 0.8655
1049 NLG 0.8655
1050 6QF 0.8655
1051 3C5 0.8654
1052 RP5 0.8654
1053 IPD 0.8654
1054 TIA 0.8653
1055 SSM 0.8653
1056 3AD 0.8653
1057 IBM 0.8652
1058 LJ3 0.8650
1059 PAU 0.8649
1060 UAY 0.8649
1061 8BD 0.8649
1062 ERZ 0.8647
1063 EZL 0.8646
1064 ANC 0.8645
1065 UN4 0.8645
1066 7VF 0.8645
1067 4TU 0.8645
1068 DBS 0.8643
1069 B4L 0.8643
1070 IM4 0.8643
1071 YKG 0.8643
1072 P1J 0.8642
1073 26C 0.8642
1074 I4D 0.8642
1075 AGI 0.8642
1076 A7K 0.8641
1077 NFA 0.8640
1078 KG1 0.8639
1079 IPE 0.8638
1080 GTV 0.8637
1081 GNV 0.8635
1082 0J5 0.8635
1083 CIT 0.8635
1084 08C 0.8633
1085 549 0.8631
1086 H0V 0.8631
1087 344 0.8630
1088 IPR 0.8629
1089 R2P 0.8629
1090 9RW 0.8627
1091 ISA 0.8627
1092 8VR 0.8626
1093 OTD 0.8625
1094 VFM 0.8624
1095 BNF 0.8624
1096 6TZ 0.8623
1097 XG1 0.8623
1098 86L 0.8622
1099 58X 0.8621
1100 27F 0.8621
1101 A63 0.8620
1102 GRF 0.8620
1103 E3X 0.8619
1104 PBG 0.8618
1105 NHT 0.8618
1106 MHK 0.8618
1107 MFR 0.8615
1108 7FF 0.8615
1109 A8K 0.8615
1110 DMA 0.8615
1111 2AL 0.8614
1112 11C 0.8612
1113 BA5 0.8611
1114 F9Y 0.8611
1115 4HB 0.8610
1116 S7P 0.8609
1117 6H2 0.8609
1118 EPR 0.8609
1119 1OS 0.8608
1120 DEE 0.8606
1121 9LI 0.8604
1122 2J1 0.8603
1123 5ZM 0.8603
1124 SYC 0.8603
1125 DBE 0.8602
1126 3YP 0.8600
1127 B85 0.8599
1128 OKM 0.8599
1129 Z70 0.8598
1130 KPA 0.8597
1131 ADN 0.8597
1132 BIK 0.8594
1133 L03 0.8594
1134 MUR 0.8593
1135 2WU 0.8591
1136 0F3 0.8591
1137 MR1 0.8590
1138 DG2 0.8590
1139 2BG 0.8590
1140 NRA 0.8587
1141 CK1 0.8586
1142 34L 0.8585
1143 J1K 0.8585
1144 PEY 0.8585
1145 1SF 0.8584
1146 UN3 0.8583
1147 MPK 0.8583
1148 B2J 0.8583
1149 3QO 0.8582
1150 3WJ 0.8581
1151 FA3 0.8580
1152 EES 0.8579
1153 SDD 0.8579
1154 W8G 0.8577
1155 42R 0.8577
1156 HNE 0.8576
1157 YI6 0.8576
1158 JF8 0.8574
1159 4K2 0.8571
1160 GI3 0.8569
1161 ML2 0.8567
1162 BZJ 0.8567
1163 K97 0.8566
1164 GL1 0.8565
1165 1FD 0.8564
1166 FA1 0.8561
1167 MS9 0.8560
1168 1WC 0.8560
1169 QBP 0.8558
1170 AIN 0.8558
1171 NOS 0.8557
1172 A4G 0.8556
1173 EMZ 0.8555
1174 U4J 0.8554
1175 LYS 0.8553
1176 R9Y 0.8550
1177 PCS 0.8550
1178 CWJ 0.8547
1179 U14 0.8543
1180 2EC 0.8541
1181 0J4 0.8538
1182 2FD 0.8537
1183 9PY 0.8536
1184 GPM 0.8534
1185 BGC 0.8533
1186 87L 0.8532
1187 0W8 0.8531
1188 BEU 0.8531
1189 O9Q 0.8530
1190 AOT 0.8529
1191 OTR 0.8527
1192 RJY 0.8526
1193 1UZ 0.8524
1194 PUR 0.8520
1195 Y4L 0.8518
1196 TLG 0.8518
1197 O9T 0.8516
1198 MR6 0.8516
1199 BPU 0.8510
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2AY3; Ligand: MPP; 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: 2ay3.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2AY3; Ligand: MPP; 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: 2ay3.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
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