Receptor
PDB id Resolution Class Description Source Keywords
3KED 2.3 Å EC: 3.4.11.2 CRYSTAL STRUCTURE OF AMINOPEPTIDASE N IN COMPLEX WITH 2,4- DIAMINOBUTYRIC ACID ESCHERICHIA COLI AMINOPEPTIDASE THERMOLYSIN LIKE ACTIVE SITE AMINO SWITCH INHIBITOR LIGAND DESIGN CELL INNER MEMBRANE CELL MEMBRANHYDROLASE MEMBRANE METAL-BINDING METALLOPROTEASE PROTEA
Ref.: DISCOVERY OF ALPHA, BETA- AND ALPHA, GAMMA-DIAMINO SCAFFOLDS FOR THE INHIBITION OF M1 FAMILY AMINOPEPT CHEMMEDCHEM V. 6 1971 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
DAB A:880;
Valid;
none;
ic50 = 3.6 mM
118.134 C4 H10 N2 O2 C(CN)...
GOL A:970;
A:971;
A:972;
A:973;
A:974;
A:975;
A:976;
A:977;
A:978;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
MLA A:990;
A:991;
A:992;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
104.061 C3 H4 O4 C(C(=...
NA A:951;
A:952;
Part of Protein;
Part of Protein;
none;
none;
submit data
22.99 Na [Na+]
ZN A:875;
Part of Protein;
none;
submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2ZXG 1.55 Å EC: 3.4.11.2 AMINOPEPTIDASE N COMPLEXED WITH THE AMINOPHOSPHINIC INHIBITO PL250, A TRANSITION STATE ANALOGUE ESCHERICHIA COLI K-12 CLAN MA FAMILY M1 ZINC PEPTIDASE INHIBITOR COMPLEX TRANSSTATE AMINOPEPTIDASE CELL INNER MEMBRANE CELL MEMBRANE HYDROLASE MEMBRANE METAL-BINDING METALLOPROTEASE PROTEA
Ref.: STRUCTURE OF AMINOPEPTIDASE N FROM ESCHERICHIA COLI COMPLEXED WITH THE TRANSITION-STATE ANALOGUE AMINOP INHIBITOR PL250 ACTA CRYSTALLOGR.,SECT.D V. 65 814 2009
Members (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 5MFT Ki = 34 nM 7MF C17 H19 Br N O2 c1ccc(cc1)....
2 3B3B - TRP C11 H12 N2 O2 c1ccc2c(c1....
3 3B2X - LYS C6 H15 N2 O2 C(CC[NH3+]....
4 4Q4I ic50 = 0.047 uM L2O VAL VAL ASP n/a n/a
5 5MFR Ki = 50000 nM 7MK C11 H16 N O2 c1ccc2c(c1....
6 3B34 - PHE C9 H11 N O2 c1ccc(cc1)....
7 2ZXG Ki = 0.00000079 M S23 C21 H27 N2 O5 P C[C@H](N)[....
8 3B37 - TYR C9 H11 N O3 c1cc(ccc1C....
9 2HPT - BES C16 H24 N2 O4 CC(C)C[C@@....
10 6G8B - 7MF C17 H19 Br N O2 c1ccc(cc1)....
11 2DQM - BES C16 H24 N2 O4 CC(C)C[C@@....
12 5MFS Ki = 330 nM 7ML C17 H20 N O2 c1ccc(cc1)....
13 3KED ic50 = 3.6 mM DAB C4 H10 N2 O2 C(CN)[C@@H....
14 3QJX - SER C3 H7 N O3 C([C@@H](C....
15 4Q4E ic50 = 0.19 uM BB2 C19 H35 N3 O5 CCCCC[C@H]....
16 3B2P - ARG C6 H15 N4 O2 C(C[C@@H](....
70% Homology Family (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 5MFT Ki = 34 nM 7MF C17 H19 Br N O2 c1ccc(cc1)....
2 3B3B - TRP C11 H12 N2 O2 c1ccc2c(c1....
3 3B2X - LYS C6 H15 N2 O2 C(CC[NH3+]....
4 4Q4I ic50 = 0.047 uM L2O VAL VAL ASP n/a n/a
5 5MFR Ki = 50000 nM 7MK C11 H16 N O2 c1ccc2c(c1....
6 3B34 - PHE C9 H11 N O2 c1ccc(cc1)....
7 2ZXG Ki = 0.00000079 M S23 C21 H27 N2 O5 P C[C@H](N)[....
8 3B37 - TYR C9 H11 N O3 c1cc(ccc1C....
9 2HPT - BES C16 H24 N2 O4 CC(C)C[C@@....
10 6G8B - 7MF C17 H19 Br N O2 c1ccc(cc1)....
11 2DQM - BES C16 H24 N2 O4 CC(C)C[C@@....
12 5MFS Ki = 330 nM 7ML C17 H20 N O2 c1ccc(cc1)....
13 3KED ic50 = 3.6 mM DAB C4 H10 N2 O2 C(CN)[C@@H....
14 3QJX - SER C3 H7 N O3 C([C@@H](C....
15 4Q4E ic50 = 0.19 uM BB2 C19 H35 N3 O5 CCCCC[C@H]....
16 3B2P - ARG C6 H15 N4 O2 C(C[C@@H](....
50% Homology Family (54)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 5MFT Ki = 34 nM 7MF C17 H19 Br N O2 c1ccc(cc1)....
2 3B3B - TRP C11 H12 N2 O2 c1ccc2c(c1....
3 3B2X - LYS C6 H15 N2 O2 C(CC[NH3+]....
4 4Q4I ic50 = 0.047 uM L2O VAL VAL ASP n/a n/a
5 5MFR Ki = 50000 nM 7MK C11 H16 N O2 c1ccc2c(c1....
6 3B34 - PHE C9 H11 N O2 c1ccc(cc1)....
7 2ZXG Ki = 0.00000079 M S23 C21 H27 N2 O5 P C[C@H](N)[....
8 3B37 - TYR C9 H11 N O3 c1cc(ccc1C....
9 2HPT - BES C16 H24 N2 O4 CC(C)C[C@@....
10 6G8B - 7MF C17 H19 Br N O2 c1ccc(cc1)....
11 2DQM - BES C16 H24 N2 O4 CC(C)C[C@@....
12 5MFS Ki = 330 nM 7ML C17 H20 N O2 c1ccc(cc1)....
13 3KED ic50 = 3.6 mM DAB C4 H10 N2 O2 C(CN)[C@@H....
14 3QJX - SER C3 H7 N O3 C([C@@H](C....
15 4Q4E ic50 = 0.19 uM BB2 C19 H35 N3 O5 CCCCC[C@H]....
16 3B2P - ARG C6 H15 N4 O2 C(C[C@@H](....
17 6EA1 Ki = 257 nM J0Y C17 H11 F7 N2 O3 c1cc(ccc1c....
18 4K5N Ki = 127 uM 1OU C8 H13 N4 O3 P [H]/N=C(/N....
19 4R5T Ki = 0.8 uM R5T C16 H20 N4 O4 CC(C)(C)OC....
20 4ZX6 Ki = 5.4 uM 4U6 C20 H24 N4 O4 CC(C)(C)C(....
21 4K5P Ki = 345 uM 1OS C8 H12 N3 O3 P [H]/N=C(c1....
22 6EAB Ki = 431 nM J2D C20 H19 F3 N2 O4 c1cc(ccc1c....
23 4ZX5 Ki = 0.64 uM 4TM C17 H20 N2 O3 S CC(C)(C)C(....
24 3EBH Ki = 478.2 nM BES C16 H24 N2 O4 CC(C)C[C@@....
25 6SBQ Ki = 0.04 uM 7ML C17 H20 N O2 c1ccc(cc1)....
26 6EE4 Ki = 202 nM J4S C19 H17 F3 N2 O3 c1cc(ccc1c....
27 4ZX4 Ki = 0.078 uM 4TL C19 H19 F3 N2 O3 CC(C)(C)C(....
28 4ZW7 Ki = 19 uM 4SZ C19 H19 F3 N2 O4 CC(C)(C)OC....
29 4ZW3 Ki = 0.027 uM 4S9 C13 H17 Br N2 O4 CC(C)(C)OC....
30 6EED Ki = 812 nM J6A C22 H23 F3 N2 O3 c1cc(ccc1c....
31 4K5M Ki = 193 uM 1OV C5 H15 N4 O3 P [H]/N=C(/N....
32 4ZW8 Ki = 1.1 uM 4T2 C20 H24 N4 O5 CC(C)(C)OC....
33 4ZX3 Ki = 0.065 uM 4TK C13 H17 Br N2 O3 CC(C)(C)C(....
34 3Q44 Ki = 490 nM D50 C23 H30 N2 O5 CC(C)C[C@@....
35 6EE3 Ki = 137 nM J4V C25 H25 F3 N2 O3 c1cc(ccc1c....
36 3Q43 Ki = 43 nM D66 C17 H26 N2 O5 CC(C)C[C@@....
37 4ZW5 Ki = 37 uM 4SA C19 H22 N2 O4 CC(C)(C)OC....
38 4X2U - TOD C16 H22 N2 O6 CC(C)C[C@H....
39 6SBR Ki = 0.005 uM L5E C11 H14 Br2 N O2 c1cc(c2c(c....
40 6EE6 Ki = 216 nM J4P C21 H21 F3 N2 O3 c1cc(ccc1c....
41 3T8V Ki = 260 nM BTJ C54 H67 N7 O11 C[C@@H](C(....
42 4K5O Ki = 104 uM 1OT C10 H12 N3 O3 P c1cnn(c1)c....
43 4R5X Ki = 5.5 uM R5X C18 H17 N5 O3 c1cc(cc(c1....
44 6EA2 Ki = 285 nM J1G C20 H19 F3 N2 O3 c1cc(ccc1c....
45 3EBI Ki = 79 nM BEY C19 H24 N O4 P c1ccc(cc1)....
46 4ZW6 Ki = 1.9 uM 4SY C17 H22 N4 O4 CC(C)(C)OC....
47 6EAA Ki = 818 nM J1V C21 H21 F3 N2 O3 c1cc(ccc1c....
48 4R5V Ki = 0.7 uM R5V C16 H20 N4 O3 CC(C)(C)C(....
49 4K5L Ki = 11 uM 19N C6 H17 N4 O3 P [H]/N=C(N)....
50 4QHP Ki = 9 nM 32Q C20 H27 N2 O4 P c1ccc(cc1)....
51 4QIR Ki = 112 nM 379 C18 H23 N2 O4 P c1ccc(cc1)....
52 4QUO Ki = 12 nM 3DZ C20 H27 N2 O4 P c1ccc(cc1)....
53 4QPE - 37E C8 H19 N2 O3 P C1CCC(CC1)....
54 4QME Ki = 302 nM 37B C19 H24 N O4 P c1ccc(cc1)....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: DAB; Similar ligands found: 48
No: Ligand ECFP6 Tc MDL keys Tc
1 DAB 1 1
2 ORN 0.615385 0.888889
3 2RA 0.590909 0.821429
4 HSE 0.583333 0.766667
5 DLY 0.571429 0.857143
6 NVA 0.56 0.689655
7 API 0.56 0.7
8 HCS 0.56 0.851852
9 SER 0.521739 0.724138
10 ABA 0.521739 0.642857
11 DSN 0.521739 0.724138
12 DBB 0.521739 0.642857
13 DGL 0.518519 0.666667
14 DGN 0.518519 0.65625
15 GLU 0.518519 0.666667
16 GGL 0.518519 0.666667
17 GLN 0.518519 0.65625
18 MSE 0.517241 0.617647
19 DCY 0.5 0.777778
20 C2N 0.5 0.678571
21 CYS 0.5 0.777778
22 NLE 0.482759 0.645161
23 ONL 0.482759 0.606061
24 ASP 0.48 0.612903
25 DAS 0.48 0.612903
26 ASN 0.48 0.636364
27 MET 0.466667 0.636364
28 11C 0.466667 0.645161
29 MD0 0.466667 0.827586
30 UN1 0.466667 0.645161
31 MED 0.466667 0.636364
32 LYS 0.451613 0.827586
33 DHH 0.451613 0.625
34 LEU 0.444444 0.6
35 AS2 0.444444 0.6
36 DAR 0.441176 0.685714
37 ARG 0.441176 0.685714
38 NPI 0.4375 0.625
39 ONH 0.4375 0.666667
40 9YT 0.4375 0.764706
41 SLZ 0.4375 0.8
42 CSS 0.428571 0.645161
43 2FM 0.424242 0.65625
44 6CL 0.424242 0.677419
45 5CT 0.414634 0.714286
46 CIR 0.411765 0.666667
47 MF3 0.411765 0.636364
48 MLZ 0.4 0.685714
Similar Ligands (3D)
Ligand no: 1; Ligand: DAB; Similar ligands found: 526
No: Ligand Similarity coefficient
1 9X7 0.9803
2 CAQ 0.9732
3 LMR 0.9655
4 3ZQ 0.9638
5 2CO 0.9636
6 ABU 0.9632
7 40O 0.9627
8 OAA 0.9614
9 VAL 0.9613
10 DE2 0.9612
11 THR 0.9601
12 BEW 0.9597
13 2KT 0.9590
14 URF 0.9588
15 KG7 0.9585
16 CRN 0.9578
17 SGL 0.9569
18 LEA 0.9556
19 ILE 0.9540
20 SSN 0.9540
21 69O 0.9537
22 ABN 0.9535
23 HZP 0.9529
24 DXX 0.9522
25 WBU 0.9502
26 AKB 0.9495
27 AMC 0.9481
28 COI 0.9480
29 39J 0.9478
30 MLT 0.9473
31 3PY 0.9472
32 DGY 0.9470
33 SYN 0.9468
34 HUI 0.9468
35 SMB 0.9467
36 KIV 0.9463
37 SIN 0.9440
38 URA 0.9437
39 1SP 0.9425
40 ALO 0.9424
41 CIZ 0.9422
42 JZ3 0.9419
43 1AB 0.9419
44 HIU 0.9415
45 MB3 0.9414
46 HSM 0.9413
47 282 0.9411
48 PYJ 0.9410
49 9YL 0.9409
50 KSW 0.9408
51 A3B 0.9405
52 HBX 0.9405
53 192 0.9389
54 IOM 0.9381
55 TEO 0.9379
56 4DX 0.9379
57 MAK 0.9378
58 IPH 0.9373
59 CMS 0.9370
60 23W 0.9369
61 03W 0.9368
62 26D 0.9357
63 TFB 0.9356
64 CEJ 0.9353
65 KMT 0.9348
66 NBE 0.9345
67 THE 0.9343
68 9CL 0.9340
69 MAE 0.9338
70 CRS 0.9334
71 TZE 0.9333
72 MLA 0.9332
73 FPI 0.9331
74 PRI 0.9328
75 FUM 0.9327
76 APY 0.9323
77 285 0.9322
78 VAH 0.9320
79 CYH 0.9313
80 EDG 0.9309
81 51F 0.9309
82 23B 0.9308
83 1AC 0.9308
84 MLI 0.9307
85 IDM 0.9302
86 7HP 0.9298
87 HPA 0.9296
88 OXE 0.9294
89 MRY 0.9293
90 NVI 0.9290
91 B24 0.9289
92 0R0 0.9289
93 HDA 0.9289
94 ITN 0.9287
95 CXL 0.9283
96 2PC 0.9283
97 NIO 0.9282
98 HAI 0.9275
99 GAG 0.9275
100 FPY 0.9275
101 ICN 0.9273
102 NCA 0.9273
103 1MR 0.9272
104 98J 0.9271
105 BEN 0.9270
106 AHB 0.9269
107 6PC 0.9261
108 278 0.9260
109 DTL 0.9259
110 1PT 0.9259
111 NK 0.9259
112 BEZ 0.9258
113 9TY 0.9257
114 2IM 0.9254
115 HGQ 0.9254
116 HY1 0.9252
117 4JU 0.9250
118 PYG 0.9250
119 FW5 0.9248
120 XYP 0.9242
121 JYD 0.9240
122 H3M 0.9239
123 ECE 0.9239
124 IDH 0.9236
125 TAR 0.9236
126 AL0 0.9236
127 HVQ 0.9234
128 JBN 0.9233
129 2IT 0.9232
130 FP2 0.9232
131 5AC 0.9231
132 R2B 0.9231
133 R1X 0.9230
134 BUA 0.9230
135 KOJ 0.9229
136 SRT 0.9224
137 2AF 0.9224
138 ADE 0.9223
139 1AN 0.9219
140 HPY 0.9218
141 PZA 0.9214
142 2MH 0.9213
143 286 0.9212
144 BAM 0.9212
145 XYS 0.9209
146 2CH 0.9207
147 BUB 0.9207
148 76X 0.9205
149 2RH 0.9204
150 8LG 0.9203
151 L89 0.9202
152 A2Q 0.9199
153 0MK 0.9198
154 284 0.9197
155 92Z 0.9195
156 JZ1 0.9194
157 GOL 0.9191
158 PRO 0.9188
159 BAL 0.9187
160 NBZ 0.9186
161 BTE 0.9182
162 QSC 0.9180
163 LER 0.9178
164 JZ0 0.9175
165 BVG 0.9173
166 SKG 0.9167
167 FCN 0.9165
168 60P 0.9165
169 9ON 0.9163
170 TDR 0.9163
171 OPE 0.9162
172 FOA 0.9161
173 280 0.9158
174 1DU 0.9157
175 6UA 0.9152
176 TP5 0.9151
177 YCP 0.9149
178 HY3 0.9147
179 R8A 0.9147
180 HTS 0.9144
181 CHT 0.9143
182 93Q 0.9140
183 S2G 0.9140
184 FLA 0.9138
185 YHO 0.9138
186 BVC 0.9138
187 2EZ 0.9138
188 XLS 0.9137
189 7CZ 0.9137
190 1MC 0.9135
191 V1L 0.9133
192 GXV 0.9133
193 273 0.9128
194 0TR 0.9127
195 MCT 0.9125
196 ROR 0.9124
197 RSF 0.9119
198 COM 0.9114
199 HIO 0.9114
200 DCD 0.9113
201 TH0 0.9111
202 ICP 0.9111
203 4ZE 0.9111
204 1LN 0.9111
205 TMZ 0.9111
206 MMZ 0.9110
207 43M 0.9107
208 IXW 0.9106
209 MLE 0.9106
210 PYF 0.9106
211 NEQ 0.9105
212 64K 0.9104
213 7EX 0.9104
214 938 0.9103
215 MWM 0.9102
216 L60 0.9102
217 HL5 0.9102
218 BTL 0.9100
219 FYU 0.9099
220 J1Z 0.9095
221 SEJ 0.9092
222 PEP 0.9092
223 AC5 0.9091
224 VGL 0.9090
225 4HO 0.9090
226 PRS 0.9089
227 ODV 0.9089
228 NMG 0.9089
229 AHR 0.9088
230 EHM 0.9087
231 M58 0.9085
232 TAY 0.9085
233 PPF 0.9085
234 2AC 0.9083
235 DUC 0.9081
236 PYC 0.9081
237 C21 0.9077
238 UNU 0.9077
239 PCA 0.9074
240 6X8 0.9072
241 TZC 0.9071
242 ZBT 0.9070
243 2AS 0.9069
244 DTU 0.9069
245 ICC 0.9067
246 XBZ 0.9066
247 2YU 0.9064
248 93B 0.9064
249 GBD 0.9061
250 FCA 0.9060
251 A8C 0.9057
252 3GR 0.9057
253 5UC 0.9056
254 A1U 0.9054
255 MLM 0.9054
256 H95 0.9053
257 XYD 0.9053
258 XYL 0.9052
259 XPO 0.9051
260 AAE 0.9051
261 JZ5 0.9051
262 RCO 0.9047
263 BMD 0.9045
264 DTI 0.9045
265 JZ9 0.9044
266 GG6 0.9042
267 PY7 0.9042
268 F05 0.9042
269 ARA 0.9036
270 TM7 0.9036
271 3CH 0.9034
272 HT4 0.9033
273 RBL 0.9032
274 O7U 0.9031
275 QFH 0.9028
276 4JO 0.9028
277 FPK 0.9027
278 1XX 0.9027
279 D2P 0.9026
280 4SD 0.9025
281 RIB 0.9023
282 SPV 0.9023
283 MPJ 0.9022
284 BAE 0.9022
285 URP 0.9020
286 JZ2 0.9018
287 4JJ 0.9018
288 0V5 0.9015
289 PEQ 0.9015
290 2MP 0.9013
291 JZ7 0.9013
292 4HA 0.9010
293 34A 0.9009
294 PYD 0.9008
295 4XR 0.9006
296 YAN 0.9005
297 PBE 0.9005
298 5MH 0.9003
299 HYP 0.9003
300 HSL 0.9000
301 4CL 0.9000
302 AG2 0.8999
303 LDU 0.8999
304 DEN 0.8998
305 LG3 0.8997
306 URQ 0.8997
307 IP0 0.8995
308 3SS 0.8994
309 CYT 0.8994
310 DFU 0.8994
311 MZG 0.8993
312 HX2 0.8991
313 BU4 0.8990
314 3HR 0.8986
315 RIP 0.8985
316 3SL 0.8983
317 ARB 0.8983
318 7N0 0.8978
319 FJO 0.8975
320 MRZ 0.8975
321 TLA 0.8975
322 2OP 0.8974
323 WTZ 0.8972
324 TAU 0.8972
325 4XX 0.8972
326 ALA 0.8972
327 VX 0.8971
328 SAR 0.8971
329 TMT 0.8970
330 5JC 0.8967
331 IMR 0.8966
332 LG5 0.8966
333 PLQ 0.8966
334 BR9 0.8965
335 BVF 0.8959
336 LNO 0.8958
337 PPR 0.8957
338 9SB 0.8956
339 OEM 0.8953
340 4AX 0.8952
341 27Y 0.8952
342 MWJ 0.8951
343 BZF 0.8950
344 GZ3 0.8948
345 OXQ 0.8947
346 TZL 0.8946
347 XUL 0.8940
348 SHF 0.8939
349 CP 0.8938
350 32O 0.8937
351 L3Q 0.8936
352 24T 0.8936
353 2DR 0.8936
354 MBN 0.8935
355 I2M 0.8934
356 NXA 0.8933
357 HQE 0.8933
358 VNJ 0.8931
359 BZI 0.8930
360 WOT 0.8929
361 4AP 0.8929
362 3AP 0.8929
363 5FX 0.8927
364 TB6 0.8927
365 3FA 0.8926
366 Y8I 0.8925
367 FPN 0.8924
368 GXE 0.8922
369 RAM 0.8922
370 ICF 0.8918
371 8X3 0.8916
372 2AP 0.8916
373 MBD 0.8916
374 TLD 0.8915
375 YTB 0.8912
376 IND 0.8911
377 PAE 0.8907
378 UYA 0.8907
379 YIV 0.8906
380 IUR 0.8906
381 GVH 0.8906
382 8EZ 0.8905
383 B3R 0.8904
384 MEU 0.8903
385 8GF 0.8902
386 HVK 0.8899
387 9PO 0.8898
388 HRZ 0.8897
389 25T 0.8896
390 FUB 0.8891
391 ATQ 0.8890
392 2HE 0.8887
393 S0H 0.8886
394 P7I 0.8885
395 HE2 0.8885
396 3MH 0.8884
397 LZ1 0.8884
398 BDR 0.8881
399 2HG 0.8879
400 FUL 0.8879
401 34V 0.8877
402 LAC 0.8875
403 7WA 0.8873
404 8EW 0.8869
405 6HQ 0.8866
406 3MC 0.8862
407 MPI 0.8862
408 KPL 0.8862
409 10L 0.8862
410 SWD 0.8862
411 IT2 0.8860
412 FLM 0.8860
413 LGA 0.8858
414 PYR 0.8857
415 0R1 0.8857
416 0CT 0.8856
417 DUB 0.8856
418 PAF 0.8855
419 RUU 0.8854
420 MPD 0.8854
421 4H2 0.8850
422 FSG 0.8849
423 HYA 0.8848
424 MSF 0.8847
425 SD4 0.8846
426 HEW 0.8846
427 ABE 0.8845
428 2MY 0.8844
429 8CL 0.8843
430 RM4 0.8842
431 FCB 0.8841
432 6MP 0.8839
433 9HX 0.8838
434 SAT 0.8835
435 2C9 0.8835
436 49F 0.8835
437 9X6 0.8835
438 CIG 0.8833
439 QDK 0.8831
440 MEV 0.8831
441 DTT 0.8830
442 9DA 0.8830
443 4JP 0.8829
444 2PG 0.8824
445 XXR 0.8824
446 HGY 0.8821
447 7VD 0.8819
448 TTO 0.8819
449 POA 0.8813
450 FFP 0.8813
451 HYN 0.8813
452 M3T 0.8811
453 6JN 0.8811
454 HGW 0.8809
455 GMN 0.8808
456 2CM 0.8806
457 RNS 0.8805
458 6MH 0.8803
459 OXM 0.8801
460 BR8 0.8800
461 DCL 0.8798
462 3CE 0.8793
463 HHN 0.8790
464 PIH 0.8785
465 Z6J 0.8783
466 SLP 0.8781
467 AGK 0.8779
468 OXL 0.8778
469 XAP 0.8775
470 F9P 0.8774
471 PCT 0.8769
472 HHQ 0.8767
473 AX2 0.8766
474 AC0 0.8766
475 275 0.8763
476 8GL 0.8762
477 GIF 0.8755
478 SNE 0.8755
479 13X 0.8752
480 9EW 0.8746
481 MUC 0.8735
482 N8P 0.8730
483 QOS 0.8725
484 TM4 0.8724
485 RB5 0.8720
486 XSP 0.8718
487 OXD 0.8717
488 3AY 0.8717
489 2HA 0.8714
490 A20 0.8710
491 BUO 0.8707
492 VPR 0.8703
493 AUD 0.8703
494 IFL 0.8702
495 WDL 0.8702
496 HLT 0.8702
497 DPJ 0.8702
498 3HG 0.8699
499 DMV 0.8692
500 RB0 0.8686
501 HHA 0.8682
502 NAK 0.8680
503 5ZE 0.8674
504 DMI 0.8665
505 TZZ 0.8660
506 2TQ 0.8652
507 HBR 0.8647
508 JAB 0.8646
509 OKG 0.8644
510 2A7 0.8644
511 PEZ 0.8643
512 12M 0.8637
513 N7P 0.8635
514 TF4 0.8634
515 GYE 0.8622
516 OSE 0.8615
517 ERH 0.8611
518 EXO 0.8609
519 3MT 0.8603
520 GOO 0.8583
521 2ZX 0.8564
522 TFS 0.8564
523 DMJ 0.8556
524 MAN 0.8554
525 2FT 0.8546
526 6CS 0.8544
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2ZXG; Ligand: S23; Similar sites found with APoc: 5
This union binding pocket(no: 1) in the query (biounit: 2zxg.bio1) has 27 residues
No: Leader PDB Ligand Sequence Similarity
1 6Q4R HJ5 17.1264
2 4KX8 L2O VAL VAL ASP 17.5862
3 2XQ0 BES 28.9557
4 4GAA BES 33.0049
5 4GAA BES 33.0049
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