Receptor
PDB id Resolution Class Description Source Keywords
4CH5 2.2 Å EC: 6.1.1.26 STRUCTURE OF PYRROLYSYL-TRNA SYNTHETASE IN COMPLEX WITH ADENYLATED PROPIONYL LYSINE METHANOSARCINA MAZEI LIGASE NON-NATURAL AMINO ACID PYRROLYSINE
Ref.: STRUCTURAL BASIS FOR THE SITE-SPECIFIC INCORPORATIO LYSINE DERIVATIVES INTO PROTEINS. PLOS ONE V. 9E96198 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
POP A:1461;
Invalid;
none;
submit data
175.959 H2 O7 P2 O[P@@...
EDO A:1456;
A:1458;
A:1459;
A:1460;
A:1457;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
submit data
62.068 C2 H6 O2 C(CO)...
YLP A:500;
Valid;
none;
submit data
531.457 C19 H30 N7 O9 P CCC(=...
MG A:1455;
Part of Protein;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6AAD 1.44 Å EC: 6.1.1.26 CRYSTAL STRUCTURE OF METHANOSARCINA MAZEI PYLRS(Y306A/Y384F) WITH MTMDZLYS METHANOSARCINA MAZEI JCM 9314 AMINOACYL-TRNA SYNTHETASE NON-NATURAL AMINO ACIDS TRANSLAT
Ref.: STRUCTURAL BASIS FOR GENETIC-CODE EXPANSION WITH BU LYSINE DERIVATIVES BY AN ENGINEERED PYRROLYSYL-TRNA SYNTHETASE. CELL CHEM BIOL V. 26 936 2019
Members (35)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 6ABL - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 2ZIN - LBY C11 H22 N2 O4 CC(C)(C)OC....
3 5K1P - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
4 4CH4 - YLC C20 H30 N7 O9 P C/C=C/C(=O....
5 4BW9 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
6 5K1X - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
7 4CS4 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
8 6AAQ Kd = 3.9 mM 9U9 C17 H26 N2 O4 C1C[C@@H]2....
9 6AAO Kd = 7.8 mM 9U0 C15 H26 N2 O4 C1CCC=CC(C....
10 6AAP - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
11 4BWA - N0B C25 H36 N7 O10 P c1nc(c2c(n....
12 4TQD - 33S C9 H10 I N O2 c1cc(cc(c1....
13 4ZIB - 4OG C11 H11 N O2 S c1ccc2c(c1....
14 6AB2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
15 4CH5 - YLP C19 H30 N7 O9 P CCC(=O)NCC....
16 6ABM - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
17 3QTC - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
18 4CS3 - AMP LYS FU0 n/a n/a
19 2ZIO - AYB C20 H32 N7 O10 P CCCOC(=O)N....
20 6AAN Kd = 1.76 mM 9TX C16 H20 N2 O4 C#Cc1cccc(....
21 2Q7G - CCL C12 H22 N2 O4 C1CCC(C1)O....
22 6AB1 - 9V0 C14 H19 N5 O4 c1ccc(c(c1....
23 2Q7E - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
24 6ABK Kd = 11.3 mM 9VF C11 H24 N2 O4 Si C[Si](C)(C....
25 6AAC - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
26 2Q7H - YLY C22 H35 N8 O9 P C[C@@H]1CC....
27 6AB0 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
28 4Q6G - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
29 4CH3 - YLB C20 H32 N7 O9 P CCCC(=O)NC....
30 6AAD Kd = 1.62 mM 9TU C16 H19 F3 N4 O4 c1cc(cc(c1....
31 2ZIM - YLY C22 H35 N8 O9 P C[C@@H]1CC....
32 4CH6 - YLA C20 H28 N7 O10 P C#CCOC(=O)....
33 2ZCE - PYL C12 H21 N3 O3 C[C@@H]1CC....
34 6AAZ - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
35 6AB8 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
70% Homology Family (35)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 6ABL - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 2ZIN - LBY C11 H22 N2 O4 CC(C)(C)OC....
3 5K1P - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
4 4CH4 - YLC C20 H30 N7 O9 P C/C=C/C(=O....
5 4BW9 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
6 5K1X - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
7 4CS4 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
8 6AAQ Kd = 3.9 mM 9U9 C17 H26 N2 O4 C1C[C@@H]2....
9 6AAO Kd = 7.8 mM 9U0 C15 H26 N2 O4 C1CCC=CC(C....
10 6AAP - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
11 4BWA - N0B C25 H36 N7 O10 P c1nc(c2c(n....
12 4TQD - 33S C9 H10 I N O2 c1cc(cc(c1....
13 4ZIB - 4OG C11 H11 N O2 S c1ccc2c(c1....
14 6AB2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
15 4CH5 - YLP C19 H30 N7 O9 P CCC(=O)NCC....
16 6ABM - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
17 3QTC - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
18 4CS3 - AMP LYS FU0 n/a n/a
19 2ZIO - AYB C20 H32 N7 O10 P CCCOC(=O)N....
20 6AAN Kd = 1.76 mM 9TX C16 H20 N2 O4 C#Cc1cccc(....
21 2Q7G - CCL C12 H22 N2 O4 C1CCC(C1)O....
22 6AB1 - 9V0 C14 H19 N5 O4 c1ccc(c(c1....
23 2Q7E - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
24 6ABK Kd = 11.3 mM 9VF C11 H24 N2 O4 Si C[Si](C)(C....
25 6AAC - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
26 2Q7H - YLY C22 H35 N8 O9 P C[C@@H]1CC....
27 6AB0 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
28 4Q6G - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
29 4CH3 - YLB C20 H32 N7 O9 P CCCC(=O)NC....
30 6AAD Kd = 1.62 mM 9TU C16 H19 F3 N4 O4 c1cc(cc(c1....
31 2ZIM - YLY C22 H35 N8 O9 P C[C@@H]1CC....
32 4CH6 - YLA C20 H28 N7 O10 P C#CCOC(=O)....
33 2ZCE - PYL C12 H21 N3 O3 C[C@@H]1CC....
34 6AAZ - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
35 6AB8 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
50% Homology Family (35)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 6ABL - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
2 2ZIN - LBY C11 H22 N2 O4 CC(C)(C)OC....
3 5K1P - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
4 4CH4 - YLC C20 H30 N7 O9 P C/C=C/C(=O....
5 4BW9 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
6 5K1X - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
7 4CS4 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
8 6AAQ Kd = 3.9 mM 9U9 C17 H26 N2 O4 C1C[C@@H]2....
9 6AAO Kd = 7.8 mM 9U0 C15 H26 N2 O4 C1CCC=CC(C....
10 6AAP - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
11 4BWA - N0B C25 H36 N7 O10 P c1nc(c2c(n....
12 4TQD - 33S C9 H10 I N O2 c1cc(cc(c1....
13 4ZIB - 4OG C11 H11 N O2 S c1ccc2c(c1....
14 6AB2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
15 4CH5 - YLP C19 H30 N7 O9 P CCC(=O)NCC....
16 6ABM - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
17 3QTC - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
18 4CS3 - AMP LYS FU0 n/a n/a
19 2ZIO - AYB C20 H32 N7 O10 P CCCOC(=O)N....
20 6AAN Kd = 1.76 mM 9TX C16 H20 N2 O4 C#Cc1cccc(....
21 2Q7G - CCL C12 H22 N2 O4 C1CCC(C1)O....
22 6AB1 - 9V0 C14 H19 N5 O4 c1ccc(c(c1....
23 2Q7E - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
24 6ABK Kd = 11.3 mM 9VF C11 H24 N2 O4 Si C[Si](C)(C....
25 6AAC - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
26 2Q7H - YLY C22 H35 N8 O9 P C[C@@H]1CC....
27 6AB0 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
28 4Q6G - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
29 4CH3 - YLB C20 H32 N7 O9 P CCCC(=O)NC....
30 6AAD Kd = 1.62 mM 9TU C16 H19 F3 N4 O4 c1cc(cc(c1....
31 2ZIM - YLY C22 H35 N8 O9 P C[C@@H]1CC....
32 4CH6 - YLA C20 H28 N7 O10 P C#CCOC(=O)....
33 2ZCE - PYL C12 H21 N3 O3 C[C@@H]1CC....
34 6AAZ - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
35 6AB8 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: YLP; Similar ligands found: 330
No: Ligand ECFP6 Tc MDL keys Tc
1 YLP 1 1
2 YLB 0.871287 0.97561
3 YLC 0.817308 0.951219
4 AYB 0.803738 0.963855
5 LAD 0.785714 0.950617
6 YLA 0.777778 0.928571
7 YLY 0.754386 0.963855
8 SRP 0.714286 0.901235
9 ME8 0.708738 0.860465
10 N0B 0.705882 0.928571
11 5AL 0.693878 0.876543
12 NB8 0.692308 0.847059
13 AMO 0.686275 0.878049
14 8LH 0.663366 0.878049
15 8QN 0.660194 0.876543
16 4AD 0.653846 0.86747
17 CA0 0.649485 0.843373
18 FA5 0.642202 0.878049
19 YAP 0.642202 0.86747
20 PAJ 0.638095 0.837209
21 KG4 0.626263 0.843373
22 8LQ 0.619048 0.878049
23 PTJ 0.614679 0.825581
24 8LE 0.61165 0.845238
25 XAH 0.607143 0.904762
26 PRX 0.60396 0.865854
27 M33 0.6 0.831325
28 A2D 0.597938 0.819277
29 TYM 0.59322 0.878049
30 WAQ 0.590909 0.925926
31 F2R 0.590164 0.883721
32 AN2 0.59 0.809524
33 AHX 0.587156 0.847059
34 DLL 0.587156 0.853659
35 BA3 0.585859 0.819277
36 1ZZ 0.585586 0.927711
37 TXA 0.585586 0.855422
38 ABM 0.581633 0.819277
39 45A 0.581633 0.819277
40 ADP 0.58 0.819277
41 B4P 0.58 0.819277
42 AP5 0.58 0.819277
43 AT4 0.574257 0.790698
44 ANP 0.571429 0.8
45 OOB 0.568807 0.853659
46 5SV 0.568807 0.891566
47 ADX 0.568627 0.747253
48 3UK 0.567568 0.843373
49 AGS 0.567308 0.781609
50 SAP 0.567308 0.781609
51 A 0.56701 0.817073
52 AMP 0.56701 0.817073
53 IOT 0.565574 0.917647
54 ARG AMP 0.564103 0.872093
55 50T 0.563107 0.788235
56 ATP 0.563107 0.819277
57 HEJ 0.563107 0.819277
58 ACP 0.563107 0.821429
59 B5V 0.5625 0.833333
60 9SN 0.561404 0.804598
61 00A 0.558559 0.813953
62 AQP 0.557692 0.819277
63 5FA 0.557692 0.819277
64 AR6 0.557692 0.841463
65 APR 0.557692 0.841463
66 B5Y 0.556522 0.845238
67 9ZD 0.554545 0.835294
68 9ZA 0.554545 0.835294
69 AU1 0.553398 0.8
70 AD9 0.552381 0.8
71 A1R 0.54955 0.902439
72 PR8 0.548673 0.962963
73 SRA 0.545455 0.77907
74 DAL AMP 0.545455 0.853659
75 FYA 0.54386 0.853659
76 3OD 0.54386 0.865854
77 B5M 0.543103 0.845238
78 ACQ 0.542056 0.821429
79 OAD 0.539823 0.865854
80 AP2 0.539216 0.833333
81 A12 0.539216 0.833333
82 HQG 0.536364 0.831325
83 ATF 0.53211 0.790698
84 ADP MG 0.528846 0.817073
85 GAP 0.527778 0.865854
86 6YZ 0.527273 0.821429
87 9X8 0.526316 0.823529
88 4UU 0.525 0.823529
89 4UV 0.521008 0.823529
90 NAI 0.520325 0.793103
91 4UW 0.520325 0.837209
92 A22 0.517857 0.809524
93 LAQ 0.516393 0.860465
94 SON 0.514286 0.878049
95 APC 0.514019 0.833333
96 TAT 0.513761 0.790698
97 T99 0.513761 0.790698
98 25A 0.513274 0.819277
99 OZV 0.513274 0.819277
100 MYR AMP 0.512821 0.904762
101 COD 0.511628 0.896552
102 ADV 0.509259 0.855422
103 RBY 0.509259 0.855422
104 ADP PO3 0.509259 0.817073
105 ATP MG 0.509259 0.817073
106 ADQ 0.508772 0.843373
107 A3R 0.508772 0.902439
108 KAA 0.508621 0.815217
109 MAP 0.504425 0.781609
110 BIS 0.504274 0.813953
111 G3A 0.504132 0.784091
112 OMR 0.504 0.916667
113 AP0 0.5 0.784091
114 48N 0.5 0.869048
115 G5P 0.5 0.784091
116 7MD 0.5 0.927711
117 TYR AMP 0.495868 0.845238
118 APC MG 0.495413 0.819277
119 M24 0.492537 0.786517
120 80F 0.492424 0.8
121 TXE 0.492063 0.835294
122 TSB 0.491228 0.741935
123 A5A 0.491071 0.75
124 5AS 0.490566 0.782609
125 GA7 0.487805 0.833333
126 AFH 0.487805 0.816092
127 25L 0.487395 0.809524
128 VO4 ADP 0.486726 0.809524
129 SSA 0.486726 0.763441
130 ADP VO4 0.486726 0.809524
131 GJV 0.485714 0.755814
132 6RE 0.485437 0.744186
133 BT5 0.484848 0.873563
134 6V0 0.484127 0.804598
135 NAX 0.484127 0.827586
136 TXD 0.484127 0.835294
137 DQV 0.483871 0.831325
138 GTA 0.483871 0.777778
139 LSS 0.482759 0.747368
140 VMS 0.482456 0.734043
141 54H 0.482456 0.734043
142 SA8 0.481818 0.776471
143 JB6 0.478992 0.835294
144 NVA LMS 0.478632 0.776596
145 53H 0.478261 0.726316
146 5CA 0.478261 0.763441
147 ADP ALF 0.477876 0.761364
148 ALF ADP 0.477876 0.761364
149 G5A 0.477477 0.782609
150 J7C 0.47619 0.752941
151 LMS 0.475728 0.728261
152 K15 0.474576 0.833333
153 NAQ 0.474453 0.825581
154 SMM 0.473684 0.752809
155 DND 0.472441 0.833333
156 NXX 0.472441 0.833333
157 GSU 0.470588 0.782609
158 DSZ 0.470085 0.763441
159 52H 0.469565 0.726316
160 7MC 0.465116 0.951807
161 LEU LMS 0.462185 0.739583
162 CNA 0.462121 0.833333
163 UP5 0.460938 0.802326
164 S7M 0.46087 0.77907
165 TAD 0.460317 0.816092
166 AMP DBH 0.459677 0.77907
167 A A 0.458333 0.797619
168 J4G 0.458333 0.890244
169 NSS 0.457627 0.744681
170 0UM 0.457627 0.853659
171 3DH 0.456311 0.714286
172 EEM 0.45614 0.738636
173 PAP 0.455357 0.807229
174 ATP A A A 0.455285 0.807229
175 ATP A 0.455285 0.807229
176 BTX 0.455224 0.862069
177 FB0 0.455172 0.88764
178 T5A 0.454545 0.840909
179 ADJ 0.454545 0.850575
180 4TC 0.453846 0.804598
181 UPA 0.453846 0.813953
182 62X 0.453782 0.793103
183 ARU 0.453782 0.775281
184 LPA AMP 0.453125 0.83908
185 AOC 0.45283 0.714286
186 YSA 0.451613 0.744681
187 SAH 0.451327 0.771084
188 SAI 0.451327 0.761905
189 5X8 0.45045 0.746988
190 SFG 0.45045 0.777778
191 ADP BMA 0.45 0.821429
192 KH3 0.448819 0.845238
193 A3D 0.448529 0.843373
194 6IA 0.447368 0.837209
195 SAM 0.447368 0.738636
196 2A5 0.446429 0.843373
197 AF3 ADP 3PG 0.446154 0.795455
198 NAE 0.446043 0.823529
199 EP4 0.445545 0.697674
200 AHZ 0.445312 0.818182
201 CAJ 0.445205 0.931035
202 NAD 0.444444 0.831325
203 0WD 0.444444 0.784091
204 5CD 0.444444 0.698795
205 6MZ 0.444444 0.807229
206 EAD 0.443662 0.827586
207 139 0.443609 0.848837
208 8PZ 0.443548 0.744681
209 PPS 0.443478 0.728261
210 XYA 0.443299 0.731707
211 RAB 0.443299 0.731707
212 ADN 0.443299 0.731707
213 9K8 0.442623 0.704082
214 ETB 0.442029 0.853933
215 DCA 0.442029 0.908046
216 CA6 0.441379 0.806122
217 8X1 0.440678 0.776596
218 A3P 0.440367 0.817073
219 A4P 0.439394 0.782609
220 AMX 0.43662 0.896552
221 0T1 0.435714 0.908046
222 P5A 0.434426 0.826087
223 5N5 0.434343 0.731707
224 CMX 0.433566 0.908046
225 7D5 0.432692 0.785714
226 A3S 0.432432 0.768293
227 P1H 0.431507 0.829545
228 7D3 0.431193 0.788235
229 6AD 0.431034 0.775281
230 DZD 0.430657 0.858824
231 A4D 0.43 0.710843
232 ATR 0.429825 0.795181
233 AR6 AR6 0.429688 0.819277
234 ZID 0.429577 0.821429
235 MHZ 0.428571 0.804598
236 NMX 0.428571 0.821053
237 7D4 0.428571 0.788235
238 HAX 0.427586 0.866667
239 HY8 0.427481 0.821429
240 M2T 0.427184 0.662921
241 DTA 0.427184 0.705882
242 CAO 0.426573 0.857143
243 A3G 0.425926 0.780488
244 NEC 0.425926 0.731707
245 COA 0.425532 0.886364
246 GEK 0.425 0.764706
247 H1Q 0.424779 0.785714
248 A3T 0.424779 0.756098
249 3AM 0.424528 0.804878
250 NAJ PZO 0.42446 0.764045
251 WSA 0.424242 0.752688
252 CA8 0.423841 0.787879
253 MTA 0.423077 0.694118
254 A3N 0.422018 0.705882
255 NDE 0.421769 0.811765
256 MCD 0.421769 0.909091
257 FCX 0.42069 0.877778
258 FAM 0.42069 0.866667
259 A2R 0.420168 0.831325
260 NO7 0.420168 0.811765
261 OZP 0.419847 0.819277
262 A7D 0.419643 0.759036
263 SXZ 0.419355 0.77907
264 1VU 0.418919 0.898876
265 S4M 0.418182 0.772727
266 B1U 0.417323 0.673267
267 COS 0.416667 0.866667
268 30N 0.416667 0.8125
269 SCD 0.416107 0.908046
270 ITT 0.415929 0.77381
271 4YB 0.415385 0.765957
272 MAO 0.414414 0.784091
273 A2P 0.414414 0.804878
274 SCO 0.413793 0.908046
275 VRT 0.413793 0.795181
276 A1S 0.413333 0.866667
277 G A A A 0.413043 0.784091
278 A G 0.413043 0.772727
279 AMP NAD 0.413043 0.831325
280 NAJ PYZ 0.412587 0.731183
281 HZ2 0.412214 0.821429
282 SOP 0.412162 0.88764
283 NDP 0.411765 0.784091
284 ACO 0.410959 0.877778
285 F0P 0.410448 0.819277
286 8Q2 0.410448 0.721649
287 FNK 0.410256 0.787234
288 U A G G 0.410072 0.772727
289 HXC 0.409091 0.888889
290 01K 0.408537 0.88764
291 0ET 0.407643 0.888889
292 2MC 0.406667 0.849462
293 NDC 0.406667 0.869048
294 FYN 0.405405 0.886364
295 3KK 0.405405 0.88764
296 3CP 0.405229 0.88764
297 NVA 2AD 0.405172 0.785714
298 KB1 0.404762 0.747126
299 3HC 0.403974 0.876405
300 IVC 0.403974 0.876405
301 BCO 0.403974 0.88764
302 CO8 0.403846 0.888889
303 2SA 0.403361 0.855422
304 NA7 0.403226 0.855422
305 649 0.402985 0.787234
306 OXK 0.402685 0.88764
307 COK 0.402685 0.866667
308 YZS 0.402685 0.806122
309 KGP 0.402685 0.806122
310 HDC 0.402516 0.888889
311 HFD 0.401709 0.781609
312 JSQ 0.401709 0.781609
313 COO 0.401316 0.866667
314 SO5 0.401316 0.816327
315 FDA 0.401316 0.793478
316 LCV 0.401316 0.816327
317 MYA 0.401274 0.888889
318 MFK 0.401274 0.888889
319 UCC 0.401274 0.888889
320 ST9 0.401274 0.888889
321 5F9 0.401274 0.888889
322 DCC 0.401274 0.888889
323 N5O 0.4 0.768293
324 GRA 0.4 0.88764
325 MRR 0.4 0.888889
326 MRS 0.4 0.888889
327 CO6 0.4 0.88764
328 DSH 0.4 0.795181
329 3NZ 0.4 0.764706
330 CMC 0.4 0.88764
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6AAD; Ligand: 9TU; Similar sites found with APoc: 17
This union binding pocket(no: 1) in the query (biounit: 6aad.bio1) has 50 residues
No: Leader PDB Ligand Sequence Similarity
1 1X54 4AD 7.29927
2 2XGT NSS 9.12409
3 2XGT NSS 9.12409
4 6AGT 9X0 14.9635
5 6AGT 9X0 14.9635
6 3G1Z AMP 16.7883
7 3G1Z AMP 16.7883
8 3A5Y KAA 17.1533
9 3A5Y KAA 17.1533
10 3A5Z KAA 17.1533
11 3A5Z KAA 17.1533
12 3REU ATP 17.5182
13 3REU ATP 17.5182
14 3NEM ATP 18.2482
15 3NEM AMO 18.2482
16 3E9I XAH 22.2628
17 3E9I XAH 22.2628
Pocket No.: 2; Query (leader) PDB : 6AAD; Ligand: 9TU; 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: 6aad.bio1) has 50 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 6AAD; Ligand: ATP; Similar sites found with APoc: 17
This union binding pocket(no: 3) in the query (biounit: 6aad.bio1) has 50 residues
No: Leader PDB Ligand Sequence Similarity
1 1X54 4AD 7.29927
2 2XGT NSS 9.12409
3 2XGT NSS 9.12409
4 6AGT 9X0 14.9635
5 6AGT 9X0 14.9635
6 3G1Z AMP 16.7883
7 3G1Z AMP 16.7883
8 3A5Y KAA 17.1533
9 3A5Y KAA 17.1533
10 3A5Z KAA 17.1533
11 3A5Z KAA 17.1533
12 3REU ATP 17.5182
13 3REU ATP 17.5182
14 3NEM ATP 18.2482
15 3NEM AMO 18.2482
16 3E9I XAH 22.2628
17 3E9I XAH 22.2628
Pocket No.: 4; Query (leader) PDB : 6AAD; Ligand: ATP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 6aad.bio1) has 50 residues
No: Leader PDB Ligand Sequence Similarity
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