Receptor
PDB id Resolution Class Description Source Keywords
4OLD 1.48 Å EC: 3.5.2.6 CRYSTAL STRUCTURE OF AMPC BETA-LACTAMASE IN COMPLEX WITH THE FORM OF (6R,7R)-7-AMINO-8-OXO-5-THIA-1-AZABICYCLO[4.2.0]OCTC ARBOXYLIC ACID ESCHERICHIA COLI AMPC BETA-LACTAMASE CLASS C HYDROLASE CEPHALOSPORINASE
Ref.: SUBSTRATE DECONSTRUCTION AND THE NONADDITIVITY OF E RECOGNITION. J.AM.CHEM.SOC. V. 136 7374 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
PO4 A:403;
A:402;
B:402;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
94.971 O4 P [O-]P...
2UZ A:401;
B:401;
Valid;
Valid;
none;
none;
submit data
218.23 C7 H10 N2 O4 S C1C=C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1PI5 1.49 Å EC: 3.5.2.6 STRUCTURE OF N289A MUTANT OF AMPC IN COMPLEX WITH SM2, CARBOXYPHENYLGLYCYLBORONIC ACID BEARING THE CEPHALOTHIN R1 S IDE CHAIN ESCHERICHIA COLI CRYSTAL STRUCTURE ENZYME INHIBITOR COMPLEX BETA-LACTAMASEHYDROLASE
Ref.: THERMODYNAMIC CYCLE ANALYSIS AND INHIBITOR DESIGN AGAINST BETA-LACTAMASE. BIOCHEMISTRY V. 42 14483 2003
Members (41)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 48 families.
1 1L2S Ki = 26 uM STC C11 H8 Cl N O4 S2 c1cc(ccc1N....
2 4OLD - 2UZ C7 H10 N2 O4 S C1C=C(NC(S....
3 4JXW Ki = 19 uM 1MW C15 H15 N O6 S2 c1cc(ccc1C....
4 4KZ8 Ki = 1.6 mM 1U6 C8 H12 N2 O2 S CCN1C(=O)C....
5 2HDU Ki = 5 mM F12 C7 H7 N O3 S CC(=O)Nc1c....
6 1KVL - KCP C14 H16 N2 O5 S2 CC1=C(N[C@....
7 1PI5 Ki = 17 nM SM2 C14 H14 B N O5 S B([C@H](c1....
8 2R9W Ki = 8 uM 23C C22 H15 N O6 c1ccc2c(c1....
9 2PU2 Ki = 37 uM DK2 C18 H13 N O7 c1cc(ccc1C....
10 1XGJ Ki = 1 uM HTC C12 H9 N O7 S2 c1cc(c(cc1....
11 1PI4 Ki = 37 nM SM3 C13 H14 B N O3 S B([C@H](c1....
12 1XGI Ki = 14 uM NST C11 H8 N2 O6 S2 c1cc(cc(c1....
13 3GV9 Ki = 7.5 mM GV9 C7 H7 N O3 S CC(=O)Nc1c....
14 1O07 - MXG C24 H36 N6 O9 S C[C@@H](C(....
15 3GTC Ki = 4.5 mM GTC C9 H13 N3 O2 S C1CC[C@H](....
16 4KZ3 Ki = 1.7 mM 1U1 C5 H4 Cl N O4 S2 c1c(c(sc1C....
17 4KZ7 Ki = 3.2 mM 1U5 C10 H14 O4 C[C@]12CC[....
18 2HDR Ki = 19 mM 4A3 C7 H7 N O3 c1cc(c(cc1....
19 1LL9 - AXL C16 H21 N3 O5 S CC1([C@@H]....
20 4JXS Ki = 18 uM 18U C13 H11 N O6 S2 c1cc(ccc1C....
21 2R9X Ki = 14 uM WH6 C23 H17 N O6 c1ccc2c(c1....
22 4KZ4 Ki = 0.07 mM 4A1 C10 H13 N O4 S CCCS(=O)(=....
23 6T5Y ic50 = 7.6 uM C8V C13 H23 N5 O7 S C1C[C@H](C....
24 4KZB Ki = 1.3 mM NZ3 C10 H13 N O4 S C[C@H](C(=....
25 1L0G - GLC FRU n/a n/a
26 1MY8 Ki = 0.035 uM SM3 C13 H14 B N O3 S B([C@H](c1....
27 2HDS Ki = 10 mM 4MB C8 H9 N O4 S CS(=O)(=O)....
28 4OKP - 2V0 C8 H12 N2 O4 S CC1=C(N[C@....
29 3GRJ Ki = 1 mM G14 C10 H8 N2 O2 c1ccc(cc1)....
30 4KZ5 Ki < 10 mM 1U3 C13 H11 Cl N2 O4 Cc1c(c(no1....
31 3GVB Ki = 2.6 mM 3GV C11 H11 N O4 c1ccc(c(c1....
32 4KZ9 - 1U7 C15 H21 N O c1ccc(cc1)....
33 3GR2 Ki = 3 mM GF4 C7 H10 N6 O CCC1=C(NN(....
34 3GSG Ki = 2 mM GF1 C12 H15 N O4 C[C@@H](C(....
35 6TPM ic50 = 6.61 uM MK7 C12 H22 N4 O6 S C1C[C@H](N....
36 4JXV Ki = 31 uM 1MU C14 H13 N O6 S2 c1cc(ccc1C....
37 2HDQ Ki = 40 mM C21 C5 H4 O2 S c1cc(sc1)C....
38 4KZ6 Ki = 0.8 mM ZB6 C10 H17 N O3 S C[C@@H]1CC....
39 3GQZ Ki = 6.7 mM GF7 C13 H13 N O4 CC(=O)c1cc....
40 5JOC - CIT C6 H8 O7 C(C(=O)O)C....
41 4KZA Ki = 0.2 mM NZ9 C8 H9 N O4 S2 c1csc(c1S(....
70% Homology Family (41)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 41 families.
1 1L2S Ki = 26 uM STC C11 H8 Cl N O4 S2 c1cc(ccc1N....
2 4OLD - 2UZ C7 H10 N2 O4 S C1C=C(NC(S....
3 4JXW Ki = 19 uM 1MW C15 H15 N O6 S2 c1cc(ccc1C....
4 4KZ8 Ki = 1.6 mM 1U6 C8 H12 N2 O2 S CCN1C(=O)C....
5 2HDU Ki = 5 mM F12 C7 H7 N O3 S CC(=O)Nc1c....
6 1KVL - KCP C14 H16 N2 O5 S2 CC1=C(N[C@....
7 1PI5 Ki = 17 nM SM2 C14 H14 B N O5 S B([C@H](c1....
8 2R9W Ki = 8 uM 23C C22 H15 N O6 c1ccc2c(c1....
9 2PU2 Ki = 37 uM DK2 C18 H13 N O7 c1cc(ccc1C....
10 1XGJ Ki = 1 uM HTC C12 H9 N O7 S2 c1cc(c(cc1....
11 1PI4 Ki = 37 nM SM3 C13 H14 B N O3 S B([C@H](c1....
12 1XGI Ki = 14 uM NST C11 H8 N2 O6 S2 c1cc(cc(c1....
13 3GV9 Ki = 7.5 mM GV9 C7 H7 N O3 S CC(=O)Nc1c....
14 1O07 - MXG C24 H36 N6 O9 S C[C@@H](C(....
15 3GTC Ki = 4.5 mM GTC C9 H13 N3 O2 S C1CC[C@H](....
16 4KZ3 Ki = 1.7 mM 1U1 C5 H4 Cl N O4 S2 c1c(c(sc1C....
17 4KZ7 Ki = 3.2 mM 1U5 C10 H14 O4 C[C@]12CC[....
18 2HDR Ki = 19 mM 4A3 C7 H7 N O3 c1cc(c(cc1....
19 1LL9 - AXL C16 H21 N3 O5 S CC1([C@@H]....
20 4JXS Ki = 18 uM 18U C13 H11 N O6 S2 c1cc(ccc1C....
21 2R9X Ki = 14 uM WH6 C23 H17 N O6 c1ccc2c(c1....
22 4KZ4 Ki = 0.07 mM 4A1 C10 H13 N O4 S CCCS(=O)(=....
23 6T5Y ic50 = 7.6 uM C8V C13 H23 N5 O7 S C1C[C@H](C....
24 4KZB Ki = 1.3 mM NZ3 C10 H13 N O4 S C[C@H](C(=....
25 1L0G - GLC FRU n/a n/a
26 1MY8 Ki = 0.035 uM SM3 C13 H14 B N O3 S B([C@H](c1....
27 2HDS Ki = 10 mM 4MB C8 H9 N O4 S CS(=O)(=O)....
28 4OKP - 2V0 C8 H12 N2 O4 S CC1=C(N[C@....
29 3GRJ Ki = 1 mM G14 C10 H8 N2 O2 c1ccc(cc1)....
30 4KZ5 Ki < 10 mM 1U3 C13 H11 Cl N2 O4 Cc1c(c(no1....
31 3GVB Ki = 2.6 mM 3GV C11 H11 N O4 c1ccc(c(c1....
32 4KZ9 - 1U7 C15 H21 N O c1ccc(cc1)....
33 3GR2 Ki = 3 mM GF4 C7 H10 N6 O CCC1=C(NN(....
34 3GSG Ki = 2 mM GF1 C12 H15 N O4 C[C@@H](C(....
35 6TPM ic50 = 6.61 uM MK7 C12 H22 N4 O6 S C1C[C@H](N....
36 4JXV Ki = 31 uM 1MU C14 H13 N O6 S2 c1cc(ccc1C....
37 2HDQ Ki = 40 mM C21 C5 H4 O2 S c1cc(sc1)C....
38 4KZ6 Ki = 0.8 mM ZB6 C10 H17 N O3 S C[C@@H]1CC....
39 3GQZ Ki = 6.7 mM GF7 C13 H13 N O4 CC(=O)c1cc....
40 5JOC - CIT C6 H8 O7 C(C(=O)O)C....
41 4KZA Ki = 0.2 mM NZ9 C8 H9 N O4 S2 c1csc(c1S(....
50% Homology Family (46)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 23 families.
1 1L2S Ki = 26 uM STC C11 H8 Cl N O4 S2 c1cc(ccc1N....
2 4OLD - 2UZ C7 H10 N2 O4 S C1C=C(NC(S....
3 4JXW Ki = 19 uM 1MW C15 H15 N O6 S2 c1cc(ccc1C....
4 4KZ8 Ki = 1.6 mM 1U6 C8 H12 N2 O2 S CCN1C(=O)C....
5 2HDU Ki = 5 mM F12 C7 H7 N O3 S CC(=O)Nc1c....
6 1KVL - KCP C14 H16 N2 O5 S2 CC1=C(N[C@....
7 1PI5 Ki = 17 nM SM2 C14 H14 B N O5 S B([C@H](c1....
8 2R9W Ki = 8 uM 23C C22 H15 N O6 c1ccc2c(c1....
9 2PU2 Ki = 37 uM DK2 C18 H13 N O7 c1cc(ccc1C....
10 1XGJ Ki = 1 uM HTC C12 H9 N O7 S2 c1cc(c(cc1....
11 1PI4 Ki = 37 nM SM3 C13 H14 B N O3 S B([C@H](c1....
12 1XGI Ki = 14 uM NST C11 H8 N2 O6 S2 c1cc(cc(c1....
13 3GV9 Ki = 7.5 mM GV9 C7 H7 N O3 S CC(=O)Nc1c....
14 1O07 - MXG C24 H36 N6 O9 S C[C@@H](C(....
15 3GTC Ki = 4.5 mM GTC C9 H13 N3 O2 S C1CC[C@H](....
16 4KZ3 Ki = 1.7 mM 1U1 C5 H4 Cl N O4 S2 c1c(c(sc1C....
17 4KZ7 Ki = 3.2 mM 1U5 C10 H14 O4 C[C@]12CC[....
18 2HDR Ki = 19 mM 4A3 C7 H7 N O3 c1cc(c(cc1....
19 1LL9 - AXL C16 H21 N3 O5 S CC1([C@@H]....
20 4JXS Ki = 18 uM 18U C13 H11 N O6 S2 c1cc(ccc1C....
21 2R9X Ki = 14 uM WH6 C23 H17 N O6 c1ccc2c(c1....
22 4KZ4 Ki = 0.07 mM 4A1 C10 H13 N O4 S CCCS(=O)(=....
23 6T5Y ic50 = 7.6 uM C8V C13 H23 N5 O7 S C1C[C@H](C....
24 4KZB Ki = 1.3 mM NZ3 C10 H13 N O4 S C[C@H](C(=....
25 1L0G - GLC FRU n/a n/a
26 1MY8 Ki = 0.035 uM SM3 C13 H14 B N O3 S B([C@H](c1....
27 2HDS Ki = 10 mM 4MB C8 H9 N O4 S CS(=O)(=O)....
28 4OKP - 2V0 C8 H12 N2 O4 S CC1=C(N[C@....
29 3GRJ Ki = 1 mM G14 C10 H8 N2 O2 c1ccc(cc1)....
30 4KZ5 Ki < 10 mM 1U3 C13 H11 Cl N2 O4 Cc1c(c(no1....
31 3GVB Ki = 2.6 mM 3GV C11 H11 N O4 c1ccc(c(c1....
32 4KZ9 - 1U7 C15 H21 N O c1ccc(cc1)....
33 3GR2 Ki = 3 mM GF4 C7 H10 N6 O CCC1=C(NN(....
34 3GSG Ki = 2 mM GF1 C12 H15 N O4 C[C@@H](C(....
35 6TPM ic50 = 6.61 uM MK7 C12 H22 N4 O6 S C1C[C@H](N....
36 4JXV Ki = 31 uM 1MU C14 H13 N O6 S2 c1cc(ccc1C....
37 2HDQ Ki = 40 mM C21 C5 H4 O2 S c1cc(sc1)C....
38 4KZ6 Ki = 0.8 mM ZB6 C10 H17 N O3 S C[C@@H]1CC....
39 3GQZ Ki = 6.7 mM GF7 C13 H13 N O4 CC(=O)c1cc....
40 5JOC - CIT C6 H8 O7 C(C(=O)O)C....
41 4KZA Ki = 0.2 mM NZ9 C8 H9 N O4 S2 c1csc(c1S(....
42 6PWM - GLY C2 H5 N O2 C(C(=O)O)N
43 6PWL - GLY C2 H5 N O2 C(C(=O)O)N
44 6KA5 - 1S7 C15 H16 N2 O5 S2 CO[C@@](C=....
45 5K1F Ki = 16.2 uM IMP C10 H13 N4 O8 P c1nc2c(n1[....
46 5K1D Ki = 20.8 uM 5GP C10 H14 N5 O8 P c1nc2c(n1[....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 2UZ; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 2UZ 1 1
2 2V0 0.410714 0.906977
Similar Ligands (3D)
Ligand no: 1; Ligand: 2UZ; Similar ligands found: 365
No: Ligand Similarity coefficient
1 VM1 0.9434
2 5F8 0.9342
3 EWG 0.9341
4 BZJ 0.9315
5 5F5 0.9311
6 A29 0.9234
7 LEL 0.9225
8 AVA 0.9212
9 14W 0.9209
10 9UL 0.9193
11 2GQ 0.9182
12 OW7 0.9155
13 IOS 0.9140
14 RKV 0.9135
15 IAC 0.9122
16 6MW 0.9118
17 DNF 0.9116
18 78Y 0.9114
19 363 0.9112
20 QUS 0.9112
21 NLA 0.9110
22 HJH 0.9105
23 NPA 0.9101
24 4TU 0.9099
25 HA5 0.9099
26 MNP 0.9093
27 6KT 0.9091
28 DNA 0.9088
29 U7E 0.9076
30 XEN 0.9059
31 5FL 0.9055
32 R20 0.9052
33 E79 0.9052
34 D2G 0.9038
35 2D2 0.9027
36 VXX 0.9010
37 DXK 0.9001
38 CH9 0.9000
39 8XL 0.8997
40 795 0.8996
41 1A7 0.8995
42 PPY 0.8993
43 60L 0.8992
44 DTR 0.8990
45 S0E 0.8987
46 M5H 0.8985
47 TRP 0.8983
48 7O4 0.8977
49 TT4 0.8977
50 P7Y 0.8977
51 PDC 0.8971
52 LGT 0.8967
53 LL1 0.8967
54 0JD 0.8961
55 HQJ 0.8960
56 8G0 0.8958
57 D3G 0.8958
58 PJW 0.8956
59 0F9 0.8955
60 DNC 0.8954
61 AZM 0.8954
62 PD2 0.8953
63 0FK 0.8944
64 67Y 0.8943
65 2O6 0.8936
66 30G 0.8935
67 PUE 0.8933
68 M1Z 0.8926
69 K48 0.8924
70 5OO 0.8923
71 FCD 0.8922
72 1VK 0.8922
73 TIA 0.8918
74 NAG 0.8918
75 KDG 0.8917
76 2HC 0.8916
77 JGB 0.8916
78 2F6 0.8908
79 5TZ 0.8904
80 YE6 0.8900
81 0LO 0.8900
82 H5B 0.8899
83 49P 0.8898
84 4FF 0.8891
85 KYN 0.8891
86 XI7 0.8890
87 YZM 0.8889
88 GJP 0.8888
89 KTW 0.8886
90 V1T 0.8884
91 BM3 0.8883
92 A5H 0.8881
93 4RU 0.8877
94 E35 0.8873
95 JAW 0.8873
96 5GT 0.8872
97 2K8 0.8872
98 4A5 0.8872
99 XDK 0.8872
100 7UZ 0.8871
101 QMS 0.8871
102 LFQ 0.8870
103 GO2 0.8870
104 CSN 0.8866
105 4I8 0.8865
106 BZQ 0.8864
107 069 0.8862
108 CKA 0.8860
109 MD6 0.8859
110 L5V 0.8857
111 J9T 0.8857
112 M02 0.8857
113 68A 0.8856
114 AUV 0.8850
115 2ZM 0.8848
116 5E5 0.8848
117 ZZA 0.8847
118 TSR 0.8846
119 ITW 0.8842
120 6NT 0.8842
121 M3Q 0.8840
122 463 0.8840
123 BIK 0.8840
124 TB8 0.8839
125 27B 0.8839
126 549 0.8838
127 BQ2 0.8836
128 GC2 0.8835
129 ESX 0.8834
130 KFN 0.8833
131 0GZ 0.8831
132 15N 0.8830
133 4Z1 0.8827
134 344 0.8821
135 3NY 0.8816
136 5NI 0.8816
137 ENO 0.8816
138 0W1 0.8815
139 VYM 0.8815
140 SLS 0.8813
141 N1E 0.8813
142 61M 0.8810
143 DHY 0.8807
144 0HN 0.8805
145 G14 0.8804
146 JB8 0.8804
147 HHS 0.8803
148 THM 0.8802
149 SSC 0.8802
150 KW8 0.8802
151 5VL 0.8801
152 L22 0.8800
153 R2P 0.8800
154 6FB 0.8799
155 4LW 0.8798
156 9FL 0.8796
157 CWJ 0.8795
158 HCA 0.8794
159 8NX 0.8790
160 P80 0.8789
161 BPY 0.8787
162 BP7 0.8786
163 7I2 0.8785
164 X48 0.8784
165 44V 0.8782
166 3EB 0.8782
167 36M 0.8781
168 3ZB 0.8781
169 FIX 0.8781
170 RVE 0.8780
171 6DP 0.8779
172 MAJ 0.8777
173 5WN 0.8775
174 DRG 0.8774
175 NGT 0.8773
176 SAF 0.8771
177 SRO 0.8771
178 GC3 0.8771
179 ODK 0.8771
180 FDR 0.8770
181 PH2 0.8770
182 3MB 0.8767
183 XCG 0.8766
184 6ME 0.8765
185 9R5 0.8763
186 SBK 0.8761
187 9ZE 0.8761
188 MZM 0.8761
189 0FR 0.8760
190 QLI 0.8760
191 MUR 0.8756
192 0UL 0.8755
193 ONR 0.8754
194 JDN 0.8753
195 4BY 0.8753
196 S3P 0.8749
197 1F1 0.8749
198 HLD 0.8749
199 X11 0.8749
200 ZSP 0.8748
201 JCZ 0.8747
202 DHC 0.8746
203 NGW 0.8745
204 6C8 0.8744
205 7UC 0.8742
206 7FF 0.8742
207 E8U 0.8742
208 CKU 0.8740
209 J6W 0.8740
210 MER 0.8739
211 5JT 0.8739
212 I2E 0.8738
213 9CE 0.8738
214 3VQ 0.8733
215 II4 0.8733
216 SKF 0.8732
217 C2Y 0.8732
218 EOL 0.8731
219 EN1 0.8731
220 790 0.8730
221 BZE 0.8729
222 ALE 0.8728
223 0NX 0.8725
224 DCZ 0.8722
225 0HO 0.8721
226 P4L 0.8719
227 REL 0.8719
228 ST3 0.8718
229 4V2 0.8718
230 X2M 0.8717
231 AMR 0.8717
232 RD4 0.8716
233 3Y7 0.8713
234 PEY 0.8711
235 GVY 0.8711
236 QIV 0.8710
237 2UD 0.8708
238 8G6 0.8708
239 4ME 0.8707
240 6R8 0.8707
241 F6P 0.8706
242 DDU 0.8703
243 6TZ 0.8703
244 FF2 0.8702
245 MPV 0.8701
246 PIQ 0.8701
247 F31 0.8699
248 OVP 0.8697
249 UNJ 0.8695
250 94W 0.8693
251 THA 0.8692
252 ZON 0.8692
253 ANC 0.8692
254 HHV 0.8690
255 PA5 0.8690
256 8HC 0.8688
257 4OG 0.8688
258 DQU 0.8686
259 NGO 0.8686
260 RA7 0.8685
261 GAE 0.8685
262 G1P 0.8684
263 ISC 0.8684
264 3BU 0.8684
265 NLG 0.8683
266 AOJ 0.8683
267 3HP 0.8682
268 1HN 0.8680
269 IOP 0.8680
270 TSS 0.8679
271 AOT 0.8677
272 2JX 0.8676
273 9BF 0.8674
274 IWT 0.8674
275 HC4 0.8673
276 A5E 0.8673
277 5B2 0.8672
278 JMG 0.8672
279 ABI 0.8672
280 P9E 0.8672
281 4KL 0.8671
282 JBZ 0.8670
283 4BL 0.8670
284 M4E 0.8669
285 GZ2 0.8669
286 E1T 0.8669
287 B21 0.8669
288 MP5 0.8669
289 HH6 0.8666
290 HNT 0.8665
291 L1T 0.8662
292 AX3 0.8662
293 DG2 0.8656
294 492 0.8656
295 F40 0.8656
296 BNL 0.8656
297 TWO 0.8655
298 X8Z 0.8655
299 PHY 0.8655
300 4GU 0.8654
301 54X 0.8651
302 KTA 0.8649
303 0DN 0.8649
304 R1P 0.8648
305 TU0 0.8640
306 67X 0.8640
307 KYA 0.8639
308 LR2 0.8634
309 J9N 0.8633
310 7QD 0.8631
311 3R4 0.8628
312 YTX 0.8628
313 A73 0.8625
314 0SY 0.8624
315 5LD 0.8622
316 WUB 0.8622
317 WLH 0.8621
318 92P 0.8617
319 FWB 0.8616
320 E3X 0.8615
321 GJK 0.8614
322 9W5 0.8613
323 X0U 0.8610
324 EV2 0.8609
325 M78 0.8608
326 ANF 0.8607
327 G6P 0.8607
328 CIR 0.8606
329 PMP 0.8604
330 OVM 0.8604
331 XFE 0.8602
332 GF4 0.8597
333 K97 0.8594
334 5RP 0.8594
335 3D8 0.8589
336 1SV 0.8587
337 A5P 0.8587
338 3VW 0.8587
339 5P3 0.8584
340 M1P 0.8577
341 ZYR 0.8575
342 Q4G 0.8571
343 HHR 0.8569
344 A9B 0.8568
345 833 0.8568
346 RES 0.8567
347 3N1 0.8567
348 5V7 0.8564
349 AA 0.8564
350 AN3 0.8564
351 DER 0.8560
352 4AV 0.8560
353 AHL 0.8559
354 428 0.8552
355 H4B 0.8549
356 QR2 0.8549
357 GHM 0.8546
358 L03 0.8545
359 EXL 0.8535
360 9JT 0.8533
361 R5P 0.8528
362 7VP 0.8525
363 3R6 0.8517
364 STT 0.8508
365 ZYQ 0.8502
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1PI5; Ligand: SM2; 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: 1pi5.bio2) has 42 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1PI5; Ligand: SM2; 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: 1pi5.bio2) has 35 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1PI5; Ligand: SM2; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 1pi5.bio1) has 46 residues
No: Leader PDB Ligand Sequence Similarity
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