Receptor
PDB id Resolution Class Description Source Keywords
5ZEF 2.01 Å EC: 3.5.3.1 CRYSTAL STRUCTURE OF ENTAMOEBA HISTOLYTICA ARGINASE IN COMPL NORVALINE AT 2.01 A ENTAMOEBA HISTOLYTICA ENTAMOEBA HISTOLYTICA METALLOENZYME INHIBITION HYDROLASE
Ref.: STRUCTURAL INSIGHTS INTO ENTAMOEBA HISTOLYTICA ARGI STRUCTURE-BASED IDENTIFICATION OF NOVEL NON-AMINO A INHIBITORS AS POTENTIAL ANTIAMOEBIC MOLECULES. FEBS J. V. 286 4135 2019
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MN B:303;
A:303;
A:302;
B:302;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
54.938 Mn [Mn+2...
GOL A:304;
A:305;
Invalid;
Invalid;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
EDO B:304;
A:306;
Invalid;
Invalid;
none;
none;
submit data
62.068 C2 H6 O2 C(CO)...
NVA A:301;
B:301;
Valid;
Valid;
none;
none;
submit data
117.146 C5 H11 N O2 CCC[C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5ZEE 1.74 Å EC: 3.5.3.1 CRYSTAL STRUCTURE OF ENTAMOEBA HISTOLYTICA ARGINASE IN COMPL N(OMEGA)-HYDROXY-L-ARGININE (NOHA) AT 1.74 A ENTAMOEBA HISTOLYTICA METALLOENZYME HYDROLASE-INHIBITOR COMPLEX
Ref.: STRUCTURAL INSIGHTS INTO ENTAMOEBA HISTOLYTICA ARGI STRUCTURE-BASED IDENTIFICATION OF NOVEL NON-AMINO A INHIBITORS AS POTENTIAL ANTIAMOEBIC MOLECULES. FEBS J. V. 286 4135 2019
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 11 families.
1 5ZEH - ORN C5 H12 N2 O2 C(C[C@@H](....
2 5ZEE - HAR C6 H14 N4 O3 C(C[C@@H](....
3 5ZEF - NVA C5 H11 N O2 CCC[C@@H](....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 8 families.
1 5ZEH - ORN C5 H12 N2 O2 C(C[C@@H](....
2 5ZEE - HAR C6 H14 N4 O3 C(C[C@@H](....
3 5ZEF - NVA C5 H11 N O2 CCC[C@@H](....
50% Homology Family (61)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 4Q3S Kd = 0.26 uM X7A C13 H28 B N2 O5 [B-](CCCC[....
2 4Q42 - ORN C5 H12 N2 O2 C(C[C@@H](....
3 4Q40 - VAL C5 H11 N O2 CC(C)[C@@H....
4 4Q3U Kd = 0.36 uM NNH C5 H12 N4 O3 [H]/N=C(/N....
5 4Q41 - LYS C6 H15 N2 O2 C(CC[NH3+]....
6 4Q3Q Kd = 1.3 uM ABH C6 H15 B N O5 [B-](CCCC[....
7 4Q3T Kd = 0.33 uM HAR C6 H14 N4 O3 C(C[C@@H](....
8 3SKK - 4U7 C7 H15 B F2 N O5 [B-](CCCC[....
9 3GN0 Ki = 3.9 mM DMO C6 H12 F2 N2 O2 C(CC(C(F)F....
10 1WVA Kd = 270 nM S2C C5 H13 B N O5 S [B-](CCSC[....
11 3KV2 Kd = 47.51 nM NNH C5 H12 N4 O3 [H]/N=C(/N....
12 2PHO Kd > 0.1 mM TSZ C H5 N3 S C(=S)(N)NN
13 6V7D ic50 = 22 nM QR4 C11 H24 B N2 O5 [B-](CCC[C....
14 4IE1 - 1EC C9 H21 B N O6 [B-](CCCC[....
15 3MFW Ki = 300 uM B3U C6 H10 N4 O2 c1c([nH]c(....
16 3LP4 Kd = 13100 nM LYS C6 H15 N2 O2 C(CC[NH3+]....
17 3GMZ - ORN C5 H12 N2 O2 C(C[C@@H](....
18 4GSZ - ABH C6 H15 B N O5 [B-](CCCC[....
19 3SJT - 5AB C7 H17 B N O5 [B-](CCCC[....
20 2PLL Kd = 5 nM ABH C6 H15 B N O5 [B-](CCCC[....
21 3MFV Ki = 3000 uM Z70 C7 H12 N4 O2 c1c([nH]c(....
22 4GSV - ABH C6 H15 B N O5 [B-](CCCC[....
23 3DJ8 - EXY C8 H15 N O3 C1[C@H](O1....
24 1WVB - S2C C5 H13 B N O5 S [B-](CCSC[....
25 4HWW ic50 = 223 nM X7A C13 H28 B N2 O5 [B-](CCCC[....
26 3E6V Kd = 147 nM ABH C6 H15 B N O5 [B-](CCCC[....
27 3THH - ABH C6 H15 B N O5 [B-](CCCC[....
28 6V7E ic50 = 2 nM QRA C12 H24 B N2 O5 [B-](CCC[C....
29 3LP7 Kd = 3600 nM HAR C6 H14 N4 O3 C(C[C@@H](....
30 2AEB Kd = 5 nM ABH C6 H15 B N O5 [B-](CCCC[....
31 3THJ - ORN C5 H12 N2 O2 C(C[C@@H](....
32 6V7F ic50 = 14 nM QRJ C12 H26 B N2 O5 [B-](CCC[C....
33 3F80 Kd = 60 uM 6HN C6 H12 N2 O4 C(CC[N+](=....
34 3E6K Kd = 7000 nM ABH C6 H15 B N O5 [B-](CCCC[....
35 4HXQ ic50 = 60 nM X8A C14 H30 B N2 O5 [B-](CCCC[....
36 4GWD - ABH C6 H15 B N O5 [B-](CCCC[....
37 6V7C ic50 = 29 nM QR1 C11 H24 B N2 O5 [B-](CCC[C....
38 4I06 ic50 = 67 nM X8A C14 H30 B N2 O5 [B-](CCCC[....
39 4IXV ic50 = 240 nM XA1 C18 H29 B Cl N2 O5 [B-](CCCC[....
40 4IE3 ic50 = 980 nM 1EE C13 H28 B N2 O6 [B-](CCCC[....
41 4IE2 ic50 = 4500 nM 1EC C9 H21 B N O6 [B-](CCCC[....
42 4HZE ic50 = 509 nM X7A C13 H28 B N2 O5 [B-](CCCC[....
43 6Q37 ic50 = 440 nM HE8 C8 H18 B N2 O5 [B-](CCC[C....
44 6Q39 ic50 = 16 nM HDQ C14 H29 B N3 O5 [B-](CCC[C....
45 4IXU ic50 = 23 nM 38I C20 H30 B Cl2 N2 O5 [B-](CCCC[....
46 4IU4 Ki ~ 10 uM S2C C5 H13 B N O5 S [B-](CCSC[....
47 4IU1 Ki ~ 50 uM NNH C5 H12 N4 O3 [H]/N=C(/N....
48 4IU5 - ORN C5 H12 N2 O2 C(C[C@@H](....
49 4IU0 Ki = 1.3 uM ABH C6 H15 B N O5 [B-](CCCC[....
50 1T5G - ARG C6 H15 N4 O2 C(C[C@@H](....
51 1D3V Kd = 0.11 uM ABH C6 H15 B N O5 [B-](CCCC[....
52 1HQG - ORN C5 H12 N2 O2 C(C[C@@H](....
53 1T4T ic50 < 400 uM DIR C4 H10 N4 O3 C([C@@H](C....
54 1T5F Ki = 60 uM DHH C7 H15 N O4 C(CCC(O)O)....
55 1P8R - S2C C5 H13 B N O5 S [B-](CCSC[....
56 1HQ5 Kd = 2.22 uM S2C C5 H13 B N O5 S [B-](CCSC[....
57 3E9B Ki = 4500 nM S2C C5 H13 B N O5 S [B-](CCSC[....
58 5ZEE - HAR C6 H14 N4 O3 C(C[C@@H](....
59 5ZEF - NVA C5 H11 N O2 CCC[C@@H](....
60 5CEV - LYS C6 H15 N2 O2 C(CC[NH3+]....
61 3CEV - ARG C6 H15 N4 O2 C(C[C@@H](....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: NVA; Similar ligands found: 52
No: Ligand ECFP6 Tc MDL keys Tc
1 NVA 1 1
2 ABA 0.636364 0.869565
3 DBB 0.636364 0.869565
4 NLE 0.62963 0.92
5 HSE 0.56 0.666667
6 DAB 0.56 0.689655
7 HCS 0.538462 0.740741
8 API 0.538462 0.714286
9 ONL 0.517241 0.785714
10 GGL 0.5 0.740741
11 MSE 0.5 0.733333
12 MET 0.5 0.758621
13 2RA 0.5 0.6
14 DGN 0.5 0.666667
15 GLU 0.5 0.740741
16 DSN 0.5 0.62069
17 SER 0.5 0.62069
18 MED 0.5 0.758621
19 DGL 0.5 0.740741
20 GLN 0.5 0.666667
21 SKJ 0.5 0.84
22 MT2 0.484848 0.657143
23 ORN 0.482759 0.714286
24 LEU 0.481481 0.8
25 CYS 0.48 0.666667
26 DCY 0.48 0.666667
27 C2N 0.48 0.692308
28 ASP 0.461538 0.62069
29 DAS 0.461538 0.62069
30 MEQ 0.454545 0.636364
31 6CL 0.454545 0.689655
32 DLY 0.451613 0.689655
33 UN1 0.451613 0.714286
34 11C 0.451613 0.714286
35 DHH 0.4375 0.689655
36 LYS 0.4375 0.666667
37 ALA 0.434783 0.652174
38 DAL 0.434783 0.652174
39 AS2 0.428571 0.666667
40 VAH 0.428571 0.714286
41 ILE 0.428571 0.833333
42 MLZ 0.428571 0.647059
43 3AR 0.425 0.621622
44 NPI 0.424242 0.689655
45 VIO 0.414634 0.638889
46 CSS 0.413793 0.6
47 26P 0.411765 0.645161
48 2FM 0.411765 0.666667
49 HL5 0.40625 0.777778
50 I2M 0.4 0.714286
51 MF3 0.4 0.645161
52 ZGL 0.4 0.645161
Similar Ligands (3D)
Ligand no: 1; Ligand: NVA; Similar ligands found: 545
No: Ligand Similarity coefficient
1 9X7 0.9816
2 LMR 0.9637
3 ASN 0.9601
4 THR 0.9600
5 MLT 0.9592
6 SSN 0.9577
7 69O 0.9572
8 2KT 0.9560
9 VAL 0.9555
10 ABU 0.9545
11 CRN 0.9541
12 OAA 0.9530
13 SGL 0.9529
14 KG7 0.9525
15 COI 0.9518
16 LEA 0.9504
17 HSM 0.9504
18 AKB 0.9500
19 1AB 0.9493
20 HZP 0.9493
21 1SP 0.9486
22 SYN 0.9484
23 9YL 0.9470
24 ABN 0.9466
25 CIZ 0.9461
26 03W 0.9461
27 AMC 0.9454
28 JYD 0.9454
29 40E 0.9446
30 SMB 0.9445
31 39J 0.9441
32 KIV 0.9426
33 3PY 0.9423
34 ITN 0.9421
35 HBX 0.9401
36 VKC 0.9388
37 SIN 0.9381
38 JZ7 0.9375
39 HUI 0.9375
40 KMT 0.9371
41 THE 0.9370
42 DE2 0.9370
43 HBA 0.9370
44 NBE 0.9369
45 PYJ 0.9368
46 DXX 0.9367
47 CMS 0.9360
48 UGC 0.9350
49 192 0.9350
50 LDU 0.9347
51 6NA 0.9346
52 9CL 0.9334
53 HIU 0.9327
54 DGY 0.9326
55 A3B 0.9325
56 IOM 0.9324
57 TEO 0.9324
58 A8C 0.9321
59 1AC 0.9321
60 CXF 0.9320
61 FP1 0.9318
62 TZE 0.9316
63 FW5 0.9315
64 BP9 0.9313
65 HTX 0.9306
66 APY 0.9306
67 EDG 0.9305
68 FUM 0.9304
69 51F 0.9303
70 PEL 0.9301
71 MAK 0.9298
72 MAE 0.9293
73 271 0.9293
74 HY1 0.9293
75 FPI 0.9290
76 23B 0.9288
77 2CO 0.9285
78 MLI 0.9284
79 MZ0 0.9284
80 B24 0.9283
81 BML 0.9281
82 NVI 0.9280
83 4VP 0.9280
84 PRI 0.9271
85 TFB 0.9268
86 1MR 0.9265
87 278 0.9263
88 DAV 0.9262
89 HDA 0.9260
90 SHO 0.9258
91 BUB 0.9253
92 CHT 0.9248
93 6PC 0.9242
94 BUA 0.9241
95 RSO 0.9240
96 261 0.9240
97 R1X 0.9237
98 2RH 0.9236
99 98J 0.9236
100 OGA 0.9231
101 MLA 0.9230
102 MZW 0.9229
103 23W 0.9223
104 DTL 0.9223
105 HVQ 0.9221
106 KOJ 0.9221
107 XYL 0.9219
108 RB5 0.9219
109 RB0 0.9219
110 3SS 0.9218
111 SRT 0.9215
112 PEA 0.9210
113 BAL 0.9205
114 TAR 0.9203
115 R2B 0.9202
116 COM 0.9202
117 MLE 0.9201
118 FAN 0.9198
119 4CH 0.9197
120 282 0.9195
121 49F 0.9193
122 IHG 0.9190
123 ALO 0.9183
124 SS2 0.9181
125 JZ1 0.9178
126 RBL 0.9175
127 AKG 0.9175
128 5AC 0.9175
129 PG3 0.9174
130 IMR 0.9172
131 MPJ 0.9168
132 286 0.9167
133 GOL 0.9165
134 HGQ 0.9164
135 ICN 0.9163
136 BNS 0.9162
137 AHB 0.9162
138 PYF 0.9162
139 280 0.9156
140 MRY 0.9154
141 5FX 0.9151
142 DPF 0.9141
143 URF 0.9141
144 LER 0.9140
145 OHG 0.9139
146 FJO 0.9139
147 1LN 0.9138
148 ITU 0.9137
149 PPF 0.9136
150 XUL 0.9135
151 ETM 0.9135
152 2MH 0.9134
153 OPE 0.9134
154 R8A 0.9132
155 GXV 0.9129
156 2EZ 0.9128
157 2LP 0.9126
158 HYA 0.9123
159 2IT 0.9123
160 AML 0.9122
161 IXW 0.9122
162 2DR 0.9121
163 LNO 0.9121
164 BAM 0.9119
165 PRO 0.9119
166 4SD 0.9118
167 1DU 0.9117
168 FBA 0.9117
169 HYP 0.9110
170 XLS 0.9110
171 QDK 0.9109
172 C2A 0.9102
173 AL0 0.9101
174 HIO 0.9101
175 4MV 0.9095
176 BVG 0.9095
177 EFS 0.9094
178 BEN 0.9093
179 BEZ 0.9093
180 FLA 0.9093
181 BXO 0.9092
182 1KA 0.9091
183 PBC 0.9088
184 ODV 0.9085
185 ROR 0.9083
186 7N0 0.9082
187 NXA 0.9079
188 NEQ 0.9074
189 O8Y 0.9074
190 PE9 0.9073
191 PY7 0.9072
192 NMG 0.9071
193 GUA 0.9070
194 BVC 0.9070
195 PLU 0.9067
196 PRS 0.9066
197 AG2 0.9063
198 DCD 0.9063
199 PEP 0.9060
200 WBU 0.9059
201 RIB 0.9058
202 4JU 0.9056
203 BTL 0.9056
204 2AS 0.9055
205 CRS 0.9055
206 O7U 0.9054
207 4HA 0.9052
208 2PC 0.9050
209 PZI 0.9048
210 P7I 0.9046
211 HPY 0.9045
212 SHV 0.9043
213 AC5 0.9041
214 S2G 0.9040
215 PZA 0.9037
216 PCA 0.9037
217 4XR 0.9036
218 NIO 0.9036
219 GZ3 0.9035
220 AHR 0.9035
221 PUT 0.9031
222 XPO 0.9030
223 SHF 0.9029
224 DYA 0.9028
225 URP 0.9027
226 3SL 0.9027
227 6JN 0.9025
228 HX3 0.9023
229 JZ4 0.9022
230 CEJ 0.9021
231 DCL 0.9020
232 NCA 0.9020
233 TAU 0.9019
234 ETX 0.9019
235 DTU 0.9017
236 8EW 0.9016
237 NLP 0.9015
238 BU4 0.9015
239 C2B 0.9012
240 IPH 0.9011
241 EHM 0.9011
242 GXE 0.9011
243 YCP 0.9010
244 P2D 0.9007
245 BAE 0.9005
246 NBN 0.9002
247 IFM 0.9002
248 QFH 0.9002
249 3GR 0.8999
250 XAP 0.8999
251 7CL 0.8997
252 9SB 0.8997
253 3HR 0.8997
254 BSX 0.8993
255 7WG 0.8991
256 URA 0.8990
257 PPR 0.8986
258 GLY GLY 0.8982
259 PHB 0.8982
260 CEE 0.8982
261 PGA 0.8980
262 HHN 0.8979
263 A20 0.8978
264 MLM 0.8977
265 HV2 0.8976
266 URQ 0.8975
267 CXL 0.8974
268 M58 0.8974
269 0V5 0.8974
270 PEQ 0.8974
271 9X6 0.8972
272 TTO 0.8971
273 TZC 0.8970
274 IQ0 0.8970
275 VX 0.8970
276 D2P 0.8969
277 3HL 0.8967
278 8CL 0.8965
279 TZL 0.8964
280 BDR 0.8962
281 3ZQ 0.8961
282 2OP 0.8961
283 BMD 0.8960
284 T6C 0.8956
285 SPV 0.8955
286 FPK 0.8955
287 IZC 0.8955
288 FPY 0.8954
289 DPJ 0.8953
290 H8N 0.8953
291 DMG 0.8953
292 GIF 0.8952
293 9ON 0.8946
294 CP 0.8944
295 KMH 0.8943
296 HX2 0.8943
297 60P 0.8943
298 SKG 0.8942
299 AGK 0.8940
300 TB6 0.8940
301 40O 0.8936
302 H95 0.8935
303 PIH 0.8933
304 AAE 0.8932
305 ICF 0.8931
306 H3M 0.8930
307 TLA 0.8928
308 XBT 0.8924
309 HAI 0.8924
310 HGW 0.8924
311 SLP 0.8923
312 SC2 0.8921
313 26D 0.8921
314 32O 0.8920
315 QY9 0.8920
316 PAF 0.8917
317 SAR 0.8917
318 2IM 0.8916
319 HY3 0.8914
320 MMZ 0.8913
321 JZ5 0.8911
322 MD0 0.8910
323 OEM 0.8910
324 DMV 0.8909
325 3CH 0.8908
326 284 0.8907
327 2EH 0.8906
328 FUB 0.8904
329 8X3 0.8902
330 DFB 0.8899
331 MBN 0.8895
332 ZBT 0.8894
333 TMH 0.8891
334 PRY 0.8891
335 TIU 0.8890
336 JFJ 0.8887
337 HHQ 0.8886
338 B3R 0.8885
339 ZZT 0.8884
340 MTG 0.8884
341 CYH 0.8883
342 AZF 0.8881
343 OXZ 0.8881
344 G4D 0.8879
345 E60 0.8878
346 WTZ 0.8877
347 MPD 0.8875
348 FSG 0.8874
349 93B 0.8872
350 MPH 0.8867
351 2HG 0.8864
352 MCT 0.8863
353 DUC 0.8863
354 IOL 0.8861
355 VGL 0.8860
356 TP5 0.8858
357 MRZ 0.8857
358 POA 0.8857
359 2HE 0.8857
360 SS1 0.8856
361 3AP 0.8855
362 NTN 0.8855
363 R67 0.8853
364 DTT 0.8852
365 7MH 0.8851
366 SD4 0.8849
367 4HS 0.8848
368 VPR 0.8846
369 S0H 0.8845
370 5HY 0.8845
371 PAE 0.8845
372 PAH 0.8845
373 LAC 0.8845
374 BHH 0.8843
375 PYD 0.8842
376 285 0.8842
377 RCO 0.8841
378 2PG 0.8840
379 RSF 0.8840
380 24T 0.8837
381 KSW 0.8837
382 34V 0.8836
383 BVF 0.8835
384 MEU 0.8833
385 24B 0.8832
386 2AC 0.8830
387 LG4 0.8830
388 3BB 0.8829
389 1SH 0.8825
390 4JJ 0.8824
391 1PT 0.8821
392 53C 0.8813
393 MZG 0.8813
394 F9P 0.8810
395 4AP 0.8809
396 AUD 0.8809
397 268 0.8809
398 CYT 0.8807
399 IDH 0.8807
400 XYD 0.8805
401 273 0.8804
402 4CL 0.8803
403 BR9 0.8801
404 4HO 0.8800
405 2YU 0.8799
406 PCR 0.8799
407 LG3 0.8798
408 LG5 0.8797
409 SR1 0.8797
410 25T 0.8796
411 5JC 0.8795
412 LYN 0.8793
413 7A8 0.8790
414 XYP 0.8790
415 13P 0.8787
416 RUU 0.8785
417 PYR 0.8784
418 27Y 0.8784
419 HEW 0.8784
420 ICC 0.8780
421 PXY 0.8780
422 CIG 0.8778
423 MWJ 0.8776
424 9TY 0.8776
425 4ZE 0.8773
426 PG0 0.8771
427 WOT 0.8771
428 JZ2 0.8770
429 MEV 0.8770
430 MWM 0.8769
431 SNE 0.8768
432 PCT 0.8768
433 Y8I 0.8767
434 A2Q 0.8766
435 SAT 0.8766
436 4CS 0.8765
437 H76 0.8764
438 GLL 0.8763
439 L60 0.8763
440 0MK 0.8762
441 HQE 0.8761
442 7VD 0.8759
443 4JM 0.8757
444 8GF 0.8757
445 1MC 0.8756
446 54D 0.8755
447 HMH 0.8754
448 T2C 0.8753
449 ECE 0.8753
450 6UA 0.8752
451 3AB 0.8752
452 P3K 0.8750
453 XBZ 0.8749
454 DHS 0.8749
455 23A 0.8749
456 S76 0.8748
457 PLQ 0.8748
458 4XX 0.8748
459 UY7 0.8745
460 34A 0.8744
461 AC0 0.8743
462 GLY ALA 0.8742
463 BUQ 0.8738
464 2AL 0.8737
465 3AL 0.8737
466 OSE 0.8736
467 2MP 0.8735
468 2HA 0.8734
469 HT4 0.8733
470 BGC 0.8731
471 NAK 0.8730
472 ICP 0.8729
473 TM7 0.8729
474 25R 0.8729
475 DPR 0.8728
476 XSP 0.8728
477 TDR 0.8725
478 4DX 0.8724
479 ACA 0.8723
480 64K 0.8720
481 GG6 0.8717
482 K6V 0.8714
483 TMZ 0.8714
484 2FT 0.8712
485 DA1 0.8710
486 3OH 0.8709
487 2A7 0.8707
488 FPN 0.8705
489 ZZ3 0.8704
490 TB0 0.8700
491 4H2 0.8698
492 EGD 0.8693
493 MUC 0.8692
494 A1U 0.8690
495 M3T 0.8690
496 X1S 0.8689
497 PBE 0.8689
498 N8P 0.8688
499 TH0 0.8686
500 SEP 0.8684
501 5MH 0.8678
502 3S5 0.8672
503 BHL 0.8671
504 DMJ 0.8670
505 HYN 0.8669
506 ATQ 0.8668
507 2XX 0.8663
508 CNH 0.8658
509 DGJ 0.8656
510 3HG 0.8655
511 RIP 0.8646
512 2TQ 0.8646
513 YHO 0.8646
514 3V4 0.8644
515 1CB 0.8638
516 ASC 0.8637
517 TLD 0.8637
518 IFL 0.8634
519 LRH 0.8634
520 PYZ 0.8633
521 TZZ 0.8631
522 AOA 0.8630
523 JIF 0.8629
524 HIS 0.8629
525 35C 0.8624
526 G2H 0.8621
527 FOC 0.8620
528 MSF 0.8620
529 PPV 0.8618
530 IT2 0.8617
531 PEZ 0.8616
532 GYE 0.8613
533 IF7 0.8603
534 J1Z 0.8598
535 HBS 0.8592
536 1SA 0.8588
537 TMT 0.8584
538 QOS 0.8579
539 ACH 0.8568
540 MYQ 0.8554
541 9RW 0.8552
542 0OC 0.8529
543 MAN 0.8523
544 3OL 0.8522
545 SEJ 0.8513
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5ZEE; Ligand: HAR; Similar sites found with APoc: 2
This union binding pocket(no: 1) in the query (biounit: 5zee.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
1 1WOG 16D 27.541
2 1WOG 16D 27.541
Pocket No.: 2; Query (leader) PDB : 5ZEE; Ligand: HAR; Similar sites found with APoc: 3
This union binding pocket(no: 2) in the query (biounit: 5zee.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
1 1WOG 16D 27.541
2 1WOG 16D 27.541
3 1WOG 16D 27.541
APoc FAQ
Feedback