Receptor
PDB id Resolution Class Description Source Keywords
1T7Q 1.8 Å EC: 2.3.1.7 CRYSTAL STRUCTURE OF THE F565A MUTANT OF MURINE CARNITINE ACETYLTRANSFERASE IN COMPLEX WITH CARNITINE AND COA MUS MUSCULUS TRANSFERASE
Ref.: STRUCTURAL AND BIOCHEMICAL STUDIES OF THE SUBSTRATE SELECTIVITY OF CARNITINE ACETYLTRANSFERASE J.BIOL.CHEM. V. 279 31584 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
152 A:1201;
B:1301;
 Valid;
Valid;
 none;
none;
 submit data
162.207 C7 H16 N O3 C[N+]...
COA A:1202;
B:1302;
 Valid;
Valid;
 none;
none;
 submit data
767.534 C21 H36 N7 O16 P3 S CC(C)...
EDO A:1203;
B:1303;
 Invalid;
Invalid;
 none;
none;
 submit data
62.068 C2 H6 O2 C(CO)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1T7Q 1.8 Å EC: 2.3.1.7 CRYSTAL STRUCTURE OF THE F565A MUTANT OF MURINE CARNITINE ACETYLTRANSFERASE IN COMPLEX WITH CARNITINE AND COA MUS MUSCULUS TRANSFERASE
Ref.: STRUCTURAL AND BIOCHEMICAL STUDIES OF THE SUBSTRATE SELECTIVITY OF CARNITINE ACETYLTRANSFERASE J.BIOL.CHEM. V. 279 31584 2004
Members (7)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1T7Q - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
2 1T7O - 152 C7 H16 N O3 C[N+](C)(C....
3 1NDI - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
4 2H3U - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
5 2H3W - HC5 C13 H26 N O4 CCCCCC(=O)....
6 1NDF - 152 C7 H16 N O3 C[N+](C)(C....
7 2H3P - ACO C23 H38 N7 O17 P3 S CC(=O)SCCN....
70% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1T7Q - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
2 1T7O - 152 C7 H16 N O3 C[N+](C)(C....
3 1NDI - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
4 2H3U - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
5 2H3W - HC5 C13 H26 N O4 CCCCCC(=O)....
6 1NDF - 152 C7 H16 N O3 C[N+](C)(C....
7 2H3P - ACO C23 H38 N7 O17 P3 S CC(=O)SCCN....
8 1S5O - 152 C7 H16 N O3 C[N+](C)(C....
50% Homology Family (17)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1T7Q - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
2 1T7O - 152 C7 H16 N O3 C[N+](C)(C....
3 1NDI - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
4 2H3U - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
5 2H3W - HC5 C13 H26 N O4 CCCCCC(=O)....
6 1NDF - 152 C7 H16 N O3 C[N+](C)(C....
7 2H3P - ACO C23 H38 N7 O17 P3 S CC(=O)SCCN....
8 2FY3 - CHT C5 H14 N O C[N+](C)(C....
9 2FY4 - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
10 7AMD Kd = 0.000000064 M RMW C39 H52 N8 O16 P3 S CC(C)(COP(....
11 2DEB - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
12 2FW3 - BUI C22 H45 N3 O3 CCCCCCCCCC....
13 4EYW - L0R C23 H26 N2 O3 c1ccc(cc1)....
14 4EPH - BOG C14 H28 O6 CCCCCCCCO[....
15 2RCU ic50 = 210 nM BUJ C23 H46 N2 O3 CCCCCCCCCC....
16 4EP9 - 0RD C24 H21 Cl N2 O6 S Cc1cc(cc2c....
17 1S5O - 152 C7 H16 N O3 C[N+](C)(C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 152; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 152 1 1
2 BET 0.461538 0.783784
Ligand no: 2; Ligand: COA; Similar ligands found: 243
No: Ligand ECFP6 Tc MDL keys Tc
1 COA 1 1
2 0T1 0.894737 0.976744
3 DCA 0.893805 0.954023
4 COS 0.887931 0.977012
5 ETB 0.877193 0.920455
6 30N 0.871795 0.913979
7 CAO 0.871795 0.965909
8 AMX 0.871795 0.988235
9 SCO 0.864407 0.976744
10 CMX 0.864407 0.976744
11 ACO 0.857143 0.965909
12 FCX 0.857143 0.94382
13 FAM 0.857143 0.954545
14 HAX 0.85 0.954545
15 FYN 0.842975 1
16 3KK 0.842975 0.977012
17 OXK 0.836066 0.977012
18 KGP 0.836066 0.885417
19 SOP 0.836066 0.977012
20 YZS 0.836066 0.885417
21 COK 0.836066 0.977012
22 MCD 0.836066 0.954545
23 CA6 0.836066 0.885417
24 1VU 0.829268 0.965909
25 CMC 0.829268 0.977012
26 CO6 0.829268 0.977012
27 NMX 0.829268 0.903226
28 CAJ 0.822581 0.954545
29 2MC 0.822581 0.934066
30 SCD 0.822581 0.976744
31 2CP 0.81746 0.965909
32 3HC 0.816 0.988372
33 KGJ 0.816 0.893617
34 A1S 0.816 0.977012
35 MLC 0.816 0.977012
36 BCO 0.816 0.977012
37 IVC 0.816 0.988372
38 1HE 0.816 0.955056
39 COD 0.810345 0.988235
40 CAA 0.809524 0.988372
41 MCA 0.809524 0.965909
42 SO5 0.809524 0.876289
43 YE1 0.809524 0.965517
44 COO 0.809524 0.977012
45 LCV 0.809524 0.876289
46 YXS 0.80315 0.885417
47 MC4 0.80315 0.923913
48 YXR 0.80315 0.885417
49 SCA 0.80315 0.977012
50 KGA 0.796875 0.884211
51 HGG 0.796875 0.977012
52 BYC 0.796875 0.977012
53 3CP 0.796875 0.977012
54 COW 0.796875 0.965909
55 CA8 0.796875 0.885417
56 1GZ 0.796875 0.965909
57 KFV 0.796875 0.894737
58 IRC 0.796875 0.988372
59 COF 0.796875 0.955056
60 2KQ 0.796875 0.955056
61 4CA 0.790698 0.965909
62 FAQ 0.790698 0.977012
63 BCA 0.790698 0.965909
64 HXC 0.784615 0.955056
65 GRA 0.784615 0.977012
66 1CV 0.781955 0.977012
67 TGC 0.778626 0.965909
68 1CZ 0.772727 0.965909
69 S0N 0.772727 0.954545
70 CO8 0.772727 0.955056
71 2NE 0.772727 0.955056
72 CIC 0.772727 0.977012
73 MYA 0.766917 0.955056
74 0FQ 0.766917 0.977012
75 DCC 0.766917 0.955056
76 5F9 0.766917 0.955056
77 UCC 0.766917 0.955056
78 MFK 0.766917 0.955056
79 ST9 0.766917 0.955056
80 4CO 0.766917 0.965909
81 01A 0.761194 0.934066
82 0ET 0.761194 0.955056
83 CS8 0.755556 0.944444
84 WCA 0.755556 0.955056
85 NHW 0.75 0.955056
86 HDC 0.75 0.955056
87 NHM 0.75 0.955056
88 4KX 0.75 0.944444
89 UOQ 0.75 0.955056
90 HFQ 0.744526 0.955056
91 MRS 0.744526 0.955056
92 MRR 0.744526 0.955056
93 J5H 0.73913 0.977012
94 YNC 0.73913 0.965909
95 DAK 0.73913 0.944444
96 COA FLC 0.736 0.965116
97 8Z2 0.733813 0.944444
98 NHQ 0.723404 0.988372
99 F8G 0.715278 0.913979
100 1HA 0.713287 0.955056
101 01K 0.708333 0.977012
102 COT 0.703448 0.977012
103 CCQ 0.695652 0.934066
104 CA3 0.693878 0.977012
105 7L1 0.692308 0.965909
106 RMW 0.682119 0.955056
107 CA5 0.671053 0.934066
108 93P 0.666667 0.965909
109 UCA 0.666667 0.955056
110 CO7 0.664234 0.977012
111 N9V 0.647887 0.922222
112 93M 0.64557 0.965909
113 OXT 0.634146 0.913979
114 4BN 0.607143 0.913979
115 5TW 0.607143 0.913979
116 BUA COA 0.605634 0.943182
117 PAP 0.603604 0.811765
118 JBT 0.598837 0.894737
119 BSJ 0.592814 0.944444
120 6NA COA 0.585034 0.922222
121 HMG 0.581081 0.943182
122 MYR COA 0.573333 0.922222
123 EO3 COA 0.573333 0.922222
124 DAO COA 0.573333 0.922222
125 DCR COA 0.573333 0.922222
126 X90 COA 0.573333 0.922222
127 DKA COA 0.573333 0.922222
128 PLM COA 0.573333 0.922222
129 A3P 0.54955 0.8
130 PPS 0.547009 0.752688
131 ASP ASP ASP ILE NH2 CMC 0.536585 0.932584
132 0WD 0.521739 0.788889
133 SFC 0.490683 0.955056
134 RFC 0.490683 0.955056
135 ACE SER ASP ALY THR NH2 COA 0.483333 0.932584
136 3AM 0.482143 0.788235
137 PTJ 0.48062 0.872093
138 MET VAL ASN ALA CMC 0.480447 0.932584
139 4PS 0.477477 0.682353
140 5AD NJS 0.47619 0.913043
141 A22 0.468254 0.813953
142 A2D 0.465517 0.802326
143 PUA 0.462585 0.820225
144 PAJ 0.460938 0.883721
145 HQG 0.460317 0.813953
146 ATR 0.459016 0.8
147 AGS 0.459016 0.806818
148 3OD 0.458015 0.825581
149 ADP 0.453782 0.823529
150 9BG 0.451389 0.788889
151 A2R 0.448819 0.813953
152 8LE 0.448 0.848837
153 ACE MET LEU GLY PRO NH2 COA 0.447917 0.932584
154 UBG 0.447853 0.844444
155 BA3 0.445378 0.802326
156 OAD 0.442748 0.825581
157 NA7 0.442748 0.858824
158 ATP 0.442623 0.823529
159 HEJ 0.442623 0.823529
160 AP5 0.441667 0.802326
161 B4P 0.441667 0.802326
162 5FA 0.439024 0.823529
163 2A5 0.439024 0.847059
164 APR 0.439024 0.802326
165 AR6 0.439024 0.802326
166 AQP 0.439024 0.823529
167 AT4 0.438017 0.816092
168 AN2 0.438017 0.813953
169 48N 0.435714 0.808989
170 JNT 0.435115 0.847059
171 M33 0.434426 0.813953
172 QA7 0.434109 0.848837
173 8LQ 0.434109 0.837209
174 9X8 0.431818 0.806818
175 SRP 0.429688 0.837209
176 ANP 0.428571 0.804598
177 ADQ 0.427481 0.804598
178 YLB 0.426573 0.908046
179 YLP 0.425532 0.886364
180 5AL 0.425197 0.813953
181 7D3 0.425 0.793103
182 AD9 0.424 0.804598
183 APU 0.423611 0.786517
184 CA0 0.422764 0.804598
185 7D4 0.422764 0.793103
186 25L 0.422222 0.813953
187 ATF 0.421875 0.795455
188 F2R 0.421769 0.865169
189 NJP 0.421769 0.806818
190 A2P 0.421488 0.788235
191 8QN 0.419847 0.813953
192 PNS 0.419643 0.682353
193 ACP 0.419355 0.825581
194 KG4 0.419355 0.804598
195 8LH 0.418605 0.837209
196 J4G 0.41791 0.848837
197 NDP 0.417808 0.788889
198 ACQ 0.417323 0.825581
199 A1R 0.416667 0.882353
200 ATP A 0.416058 0.770115
201 ATP A A A 0.416058 0.770115
202 AMP 0.415254 0.8
203 A 0.415254 0.8
204 1ZZ 0.414815 0.842697
205 TXA 0.414815 0.816092
206 FYA 0.414815 0.813953
207 NB8 0.414815 0.808989
208 00A 0.413534 0.758242
209 DLL 0.413534 0.793103
210 AHX 0.413534 0.829545
211 PAX 0.412903 0.793478
212 DQV 0.411348 0.813953
213 OMR 0.409722 0.853933
214 9ZD 0.409091 0.818182
215 25A 0.409091 0.802326
216 9ZA 0.409091 0.818182
217 OOB 0.409091 0.793103
218 NPW 0.408163 0.822222
219 6YZ 0.407692 0.825581
220 WAQ 0.407407 0.860465
221 TAT 0.40625 0.816092
222 T99 0.40625 0.816092
223 4AD 0.406015 0.827586
224 AMO 0.406015 0.837209
225 A3R 0.406015 0.882353
226 B5Y 0.405797 0.786517
227 FA5 0.405797 0.816092
228 KMQ 0.405797 0.795455
229 TXP 0.405405 0.829545
230 45A 0.404959 0.781609
231 ABM 0.404959 0.781609
232 PRX 0.404762 0.825581
233 ME8 0.404412 0.842697
234 BIS 0.404412 0.818182
235 AFH 0.404255 0.78022
236 J7V 0.403846 0.778947
237 LQJ 0.402878 0.781609
238 NAI 0.402778 0.777778
239 ODP 0.402685 0.78022
240 DAL AMP 0.401515 0.793103
241 SRA 0.4 0.784091
242 ADX 0.4 0.752688
243 AU1 0.4 0.804598
Similar Ligands (3D)
Ligand no: 1; Ligand: 152; Similar ligands found: 725
No: Ligand Similarity coefficient
1 GVM 0.9852
2 HBU 0.9654
3 TPO 0.9648
4 IP8 0.9626
5 GPJ 0.9615
6 CCE 0.9614
7 3HG 0.9608
8 ACH 0.9584
9 GPF 0.9556
10 NM2 0.9553
11 NM3 0.9553
12 AT3 0.9539
13 6JN 0.9533
14 CHH 0.9519
15 CCD 0.9507
16 3PG 0.9481
17 AMS 0.9474
18 SAN 0.9467
19 TIU 0.9462
20 KMH 0.9438
21 RUJ 0.9422
22 B85 0.9416
23 PEP 0.9392
24 RTK 0.9388
25 FCR 0.9380
26 4LR 0.9364
27 GUA 0.9362
28 0V5 0.9348
29 PC 0.9344
30 AAS 0.9340
31 URO 0.9340
32 TSU 0.9338
33 OSE 0.9334
34 13P 0.9327
35 NSB 0.9307
36 SPV 0.9301
37 FM4 0.9297
38 PPR 0.9291
39 1SA 0.9290
40 J9N 0.9289
41 5XB 0.9286
42 MAH 0.9285
43 OTR 0.9285
44 AKG 0.9284
45 OGA 0.9281
46 3SL 0.9281
47 OEG 0.9277
48 PEQ 0.9274
49 M4S 0.9272
50 FOM 0.9267
51 MUC 0.9264
52 MZT 0.9263
53 G3H 0.9260
54 3S5 0.9260
55 8EW 0.9258
56 36E 0.9255
57 FBS 0.9250
58 4P5 0.9239
59 HPV 0.9234
60 X1S 0.9234
61 X0V 0.9231
62 MSL 0.9229
63 GLU 0.9224
64 E4P 0.9221
65 4J8 0.9220
66 SEP 0.9218
67 S7J 0.9218
68 4WL 0.9217
69 HIS 0.9217
70 MSR 0.9216
71 RNS 0.9215
72 HG3 0.9215
73 GCO 0.9213
74 RAT 0.9212
75 HHI 0.9208
76 0VT 0.9206
77 A3M 0.9200
78 CPZ 0.9200
79 R67 0.9199
80 1X4 0.9199
81 SOL 0.9196
82 LTL 0.9195
83 2BX 0.9190
84 URP 0.9188
85 CS2 0.9188
86 FUD 0.9186
87 DHM 0.9182
88 4ZA 0.9180
89 AHN 0.9176
90 CCU 0.9176
91 2HG 0.9175
92 Q9Z 0.9173
93 3AE 0.9169
94 KVP 0.9168
95 PO6 0.9162
96 2IT 0.9154
97 GGL 0.9154
98 LR5 0.9153
99 HDH 0.9151
100 PIY 0.9150
101 ANN 0.9150
102 HHH 0.9147
103 GZ3 0.9146
104 2PG 0.9141
105 KTA 0.9140
106 K34 0.9138
107 F4E 0.9136
108 CCB 0.9135
109 PNZ 0.9131
110 1GP 0.9129
111 REL 0.9125
112 G3P 0.9123
113 4BZ 0.9120
114 PIM 0.9118
115 GP9 0.9116
116 DGN 0.9114
117 M3H 0.9114
118 DHI 0.9112
119 PGH 0.9110
120 FK8 0.9110
121 EKZ 0.9110
122 SNU 0.9108
123 7UC 0.9107
124 GLN 0.9106
125 TYL 0.9105
126 K6V 0.9103
127 OOG 0.9103
128 3LR 0.9102
129 Q07 0.9100
130 9GB 0.9100
131 IFP 0.9099
132 DAL DAL 0.9097
133 AG2 0.9096
134 BZ2 0.9095
135 ESX 0.9095
136 PEZ 0.9095
137 R9M 0.9092
138 ONL 0.9091
139 S2G 0.9091
140 QMP 0.9090
141 ESP 0.9089
142 4FH 0.9088
143 7BC 0.9088
144 0L1 0.9086
145 LUQ 0.9084
146 49F 0.9082
147 PHB 0.9081
148 HX4 0.9080
149 FBF 0.9079
150 5LD 0.9078
151 DE5 0.9078
152 PBZ 0.9074
153 RNT 0.9073
154 ICF 0.9070
155 PGA 0.9070
156 FB1 0.9068
157 HBD 0.9067
158 NLP 0.9064
159 IWT 0.9061
160 36Y 0.9060
161 PLU 0.9059
162 PH3 0.9055
163 2FT 0.9050
164 DZA 0.9049
165 M45 0.9046
166 7VP 0.9045
167 TRC 0.9044
168 5LA 0.9043
169 S8V 0.9041
170 L14 0.9041
171 BNL 0.9040
172 DII 0.9034
173 LFC 0.9034
174 EOU 0.9034
175 ASP 0.9033
176 FBV 0.9030
177 P72 0.9030
178 DYT 0.9028
179 3YP 0.9028
180 CFI 0.9028
181 LQ2 0.9025
182 NPO 0.9025
183 SOR 0.9025
184 41K 0.9024
185 ACA 0.9023
186 HNK 0.9022
187 HNL 0.9022
188 51R 0.9022
189 SN4 0.9021
190 4SX 0.9021
191 ISZ 0.9021
192 6FZ 0.9021
193 LMR 0.9020
194 GLO 0.9019
195 3PO 0.9015
196 TPA 0.9013
197 AC6 0.9012
198 B40 0.9011
199 MTL 0.9010
200 KPC 0.9009
201 UN1 0.9008
202 B3U 0.9005
203 6NT 0.9004
204 ICB 0.9004
205 SSC 0.9004
206 IVL 0.9003
207 PAB 0.9003
208 DHS 0.9002
209 EVF 0.9001
210 XIY 0.9000
211 4JC 0.9000
212 HSO 0.9000
213 PDC 0.8999
214 ASN 0.8997
215 TCA 0.8997
216 11C 0.8997
217 PPK 0.8996
218 SD4 0.8994
219 XIZ 0.8994
220 650 0.8993
221 PHU 0.8992
222 3BU 0.8990
223 DPN 0.8988
224 4NZ 0.8988
225 0FA 0.8986
226 IXW 0.8985
227 MLT 0.8985
228 KBZ 0.8984
229 MEV 0.8980
230 Q03 0.8980
231 4NB 0.8980
232 M4T 0.8977
233 OW4 0.8977
234 Q02 0.8975
235 1DV 0.8974
236 AEG 0.8974
237 XCZ 0.8974
238 PAC 0.8972
239 HCI 0.8969
240 KDG 0.8967
241 GJZ 0.8966
242 3NY 0.8964
243 PBA 0.8962
244 M44 0.8962
245 4MA 0.8960
246 XX3 0.8960
247 3OC 0.8959
248 PHE 0.8959
249 DBX 0.8958
250 FBB 0.8958
251 NCT 0.8956
252 0BP 0.8954
253 M74 0.8952
254 KPA 0.8951
255 AOT 0.8950
256 9ON 0.8949
257 TZF 0.8949
258 XLS 0.8949
259 7WG 0.8946
260 OKG 0.8946
261 1M2 0.8945
262 O45 0.8945
263 XXG 0.8945
264 2AL 0.8943
265 3AL 0.8943
266 3HP 0.8941
267 1Y6 0.8941
268 JAW 0.8941
269 SSB 0.8937
270 YRL 0.8936
271 6NI 0.8935
272 HGA 0.8934
273 HQJ 0.8931
274 QDK 0.8931
275 DXG 0.8930
276 ALA ALA 0.8930
277 0HN 0.8930
278 UFV 0.8930
279 OVM 0.8930
280 9SE 0.8929
281 DGL 0.8929
282 R9S 0.8929
283 R2P 0.8926
284 ENV 0.8926
285 2ZM 0.8924
286 A29 0.8924
287 826 0.8922
288 OAA 0.8922
289 SG3 0.8921
290 ET2 0.8921
291 5NI 0.8919
292 FBW 0.8919
293 DIR 0.8919
294 5FX 0.8916
295 4LW 0.8914
296 A5E 0.8913
297 TIH 0.8913
298 QY9 0.8913
299 OK7 0.8912
300 GBN 0.8911
301 40F 0.8910
302 LNR 0.8908
303 LEU 0.8907
304 449 0.8907
305 MPH 0.8907
306 SHV 0.8903
307 NF3 0.8902
308 M6H 0.8902
309 LNO 0.8902
310 SNO 0.8901
311 SYM 0.8900
312 4CS 0.8899
313 E79 0.8899
314 FOC 0.8899
315 S7A 0.8899
316 RNO 0.8898
317 DEZ 0.8897
318 3A9 0.8897
319 HC4 0.8895
320 DOB 0.8894
321 HPN 0.8893
322 LPK 0.8893
323 DLT 0.8892
324 PPY 0.8892
325 3PP 0.8891
326 HIC 0.8891
327 CUW 0.8891
328 1CO 0.8890
329 ZGL 0.8890
330 AL0 0.8890
331 N6C 0.8889
332 NFA 0.8889
333 8G0 0.8888
334 L99 0.8886
335 3MB 0.8885
336 EXD 0.8885
337 C1M 0.8885
338 AMH 0.8884
339 INO 0.8884
340 MES 0.8883
341 PD2 0.8882
342 ORN 0.8882
343 FB2 0.8882
344 C5A 0.8882
345 4NM 0.8880
346 PMB 0.8880
347 SAF 0.8879
348 2HU 0.8879
349 RBL 0.8879
350 HFA 0.8879
351 SW7 0.8877
352 ES2 0.8877
353 8WO 0.8875
354 HMS 0.8875
355 EYK 0.8875
356 4BY 0.8874
357 XRG 0.8873
358 NIZ 0.8871
359 BHO 0.8869
360 XUL 0.8868
361 Z82 0.8868
362 9J3 0.8867
363 KJU 0.8866
364 AEF 0.8866
365 8GL 0.8866
366 J0Z 0.8865
367 23J 0.8864
368 8OZ 0.8864
369 IZC 0.8863
370 1F1 0.8862
371 DER 0.8862
372 PMF 0.8861
373 K2T 0.8861
374 F4K 0.8860
375 MAJ 0.8860
376 DXP 0.8860
377 GOJ 0.8859
378 4PN 0.8859
379 I4B 0.8859
380 93K 0.8857
381 HNH 0.8856
382 ICO 0.8856
383 DHR 0.8855
384 MPV 0.8854
385 JZA 0.8853
386 3AB 0.8853
387 4M0 0.8852
388 DAS 0.8852
389 J6W 0.8851
390 BZ3 0.8850
391 5OB 0.8850
392 E5X 0.8848
393 M75 0.8848
394 GLR 0.8845
395 J9T 0.8843
396 B3M 0.8842
397 6TZ 0.8841
398 URS 0.8840
399 8K2 0.8840
400 4HP 0.8840
401 1AL 0.8837
402 4JT 0.8837
403 5CU 0.8837
404 CMS 0.8835
405 1L5 0.8832
406 173 0.8831
407 FA1 0.8830
408 S0E 0.8830
409 TYE 0.8829
410 R20 0.8826
411 2F6 0.8826
412 NLE 0.8825
413 SME 0.8822
414 GAB 0.8822
415 7C3 0.8822
416 Z13 0.8821
417 YZM 0.8820
418 M2K 0.8819
419 CXP 0.8819
420 PSJ 0.8817
421 ABI 0.8817
422 BPN 0.8814
423 CIT 0.8813
424 BHU 0.8813
425 4NC 0.8813
426 0HO 0.8812
427 RBJ 0.8812
428 5XC 0.8811
429 FLC 0.8808
430 DHB 0.8808
431 HBA 0.8808
432 2BG 0.8807
433 JLZ 0.8807
434 3HB 0.8806
435 SYC 0.8805
436 PG3 0.8803
437 RMN 0.8802
438 GLY GLY 0.8801
439 1BN 0.8801
440 A7N 0.8800
441 FA0 0.8800
442 OVV 0.8796
443 DHY 0.8796
444 I3E 0.8796
445 JDN 0.8796
446 X1R 0.8795
447 GWM 0.8794
448 DS0 0.8793
449 PRA 0.8793
450 94W 0.8792
451 C2Y 0.8792
452 DA4 0.8791
453 TLA 0.8790
454 53C 0.8789
455 SIF 0.8789
456 129 0.8788
457 DYA 0.8787
458 I3A 0.8787
459 5RN 0.8784
460 BNF 0.8784
461 F98 0.8783
462 4JQ 0.8782
463 XM0 0.8781
464 L5V 0.8779
465 GVG 0.8779
466 LYS 0.8779
467 6NA 0.8779
468 HA5 0.8779
469 2TQ 0.8779
470 4TB 0.8777
471 EN1 0.8777
472 4LV 0.8776
473 92P 0.8775
474 TEO 0.8772
475 MWP 0.8771
476 RP3 0.8771
477 268 0.8771
478 259 0.8770
479 LX1 0.8770
480 TAG 0.8770
481 LVD 0.8769
482 97T 0.8769
483 PZM 0.8768
484 NCD 0.8767
485 069 0.8766
486 K7M 0.8766
487 SMN 0.8765
488 4VP 0.8765
489 0NX 0.8764
490 GRO 0.8764
491 EHM 0.8763
492 HPP 0.8763
493 HYA 0.8762
494 MEQ 0.8762
495 FUM 0.8760
496 CWJ 0.8758
497 HL5 0.8757
498 7N0 0.8757
499 0OC 0.8756
500 IHB 0.8756
501 4FA 0.8756
502 MPJ 0.8756
503 HF2 0.8755
504 COI 0.8755
505 JB8 0.8753
506 9RH 0.8752
507 3BZ 0.8751
508 SIN 0.8751
509 SHI 0.8750
510 3ZB 0.8748
511 MYJ 0.8748
512 ONR 0.8748
513 IOM 0.8747
514 MVH 0.8747
515 LLH 0.8746
516 SVD 0.8746
517 JYD 0.8745
518 UNJ 0.8744
519 D5X 0.8742
520 DLY 0.8742
521 LYN 0.8738
522 TAR 0.8738
523 GLL 0.8737
524 N2I 0.8734
525 258 0.8734
526 OW7 0.8733
527 DAV 0.8733
528 9FL 0.8733
529 9RW 0.8732
530 KVV 0.8732
531 428 0.8731
532 5GU 0.8730
533 J9Q 0.8730
534 0F9 0.8729
535 H42 0.8728
536 M5E 0.8728
537 DAR 0.8727
538 ARG 0.8727
539 RUY 0.8727
540 M4E 0.8726
541 AES 0.8725
542 3NT 0.8724
543 TGX 0.8723
544 52C 0.8723
545 LDP 0.8722
546 5RG 0.8722
547 HIO 0.8722
548 GAE 0.8722
549 36R 0.8720
550 ESI 0.8720
551 PZI 0.8719
552 SYV 0.8719
553 56D 0.8717
554 TSS 0.8717
555 BCU 0.8716
556 VKC 0.8715
557 HPS 0.8715
558 AFS 0.8714
559 GTK 0.8713
560 6KT 0.8710
561 RB5 0.8709
562 6M4 0.8709
563 717 0.8707
564 MR1 0.8707
565 GTQ 0.8707
566 N9J 0.8706
567 CRN 0.8706
568 P9P 0.8706
569 DNF 0.8705
570 F31 0.8705
571 3QM 0.8705
572 8ZE 0.8703
573 2O6 0.8701
574 SHA 0.8701
575 HSX 0.8700
576 MHO 0.8700
577 5XA 0.8698
578 QSB 0.8698
579 NYL 0.8697
580 2HO 0.8697
581 3FH 0.8696
582 4A5 0.8696
583 KTJ 0.8694
584 JF6 0.8692
585 XX2 0.8691
586 ROR 0.8688
587 1FD 0.8688
588 92G 0.8688
589 PJW 0.8687
590 2FY 0.8687
591 CHB 0.8686
592 463 0.8683
593 RLG 0.8683
594 KOJ 0.8683
595 ASC 0.8682
596 CXF 0.8682
597 1P3 0.8676
598 ICT 0.8676
599 M6W 0.8674
600 86L 0.8674
601 FBM 0.8669
602 9TZ 0.8667
603 PKU 0.8666
604 SRT 0.8666
605 NXA 0.8666
606 BHA 0.8665
607 0LH 0.8664
608 GGB 0.8663
609 GVY 0.8663
610 PAH 0.8662
611 9TW 0.8662
612 HTX 0.8662
613 45L 0.8662
614 HL4 0.8661
615 XYL 0.8661
616 JA8 0.8660
617 OMD 0.8658
618 54G 0.8657
619 TZM 0.8657
620 PG0 0.8657
621 7MU 0.8656
622 VNL 0.8656
623 FAN 0.8656
624 ISA 0.8654
625 ODO 0.8654
626 4CM 0.8653
627 12T 0.8652
628 2AS 0.8652
629 PEA 0.8651
630 OVP 0.8650
631 S2P 0.8649
632 5NU 0.8648
633 N4B 0.8646
634 5M0 0.8645
635 EUG 0.8643
636 ABV 0.8642
637 P80 0.8639
638 1Z6 0.8639
639 BHH 0.8637
640 NVU 0.8636
641 I1E 0.8635
642 BEN 0.8634
643 P81 0.8634
644 WCE 0.8634
645 XDK 0.8632
646 BNS 0.8631
647 RSO 0.8631
648 CH9 0.8630
649 BVA 0.8630
650 KBB 0.8630
651 TYR 0.8630
652 RA7 0.8629
653 AHC 0.8628
654 ALE 0.8627
655 V55 0.8624
656 RM1 0.8622
657 MET 0.8622
658 P7Y 0.8622
659 FRU 0.8622
660 FQI 0.8618
661 E7Z 0.8617
662 TT4 0.8615
663 AM4 0.8614
664 MLE 0.8614
665 FP1 0.8613
666 SC2 0.8612
667 PPT 0.8612
668 N2Z 0.8612
669 F12 0.8612
670 DTY 0.8610
671 2D8 0.8609
672 F9P 0.8605
673 4YO 0.8603
674 KTW 0.8600
675 MSE 0.8600
676 2CO 0.8600
677 GO2 0.8599
678 RJY 0.8598
679 YPN 0.8597
680 16D 0.8596
681 CYX 0.8594
682 C2B 0.8594
683 RD4 0.8592
684 OHP 0.8592
685 BZX 0.8592
686 ENO 0.8591
687 JRB 0.8591
688 261 0.8590
689 5QY 0.8589
690 HX2 0.8589
691 8GC 0.8589
692 FHC 0.8587
693 ORO 0.8585
694 PCA 0.8582
695 HSE 0.8581
696 FBA 0.8575
697 4V2 0.8574
698 42C 0.8574
699 RES 0.8570
700 A09 0.8570
701 9FE 0.8570
702 E0O 0.8570
703 HJH 0.8567
704 14J 0.8566
705 15N 0.8565
706 NCA 0.8562
707 AX3 0.8561
708 CLW 0.8560
709 4MV 0.8556
710 C82 0.8553
711 IPB 0.8552
712 LLQ 0.8551
713 2UB 0.8549
714 2QC 0.8549
715 XCG 0.8548
716 D48 0.8540
717 A20 0.8540
718 SPA 0.8539
719 AKH 0.8534
720 PSE 0.8533
721 XAN 0.8530
722 AAN 0.8526
723 4SD 0.8526
724 54Z 0.8525
725 3PF 0.8517
Ligand no: 2; Ligand: COA; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1T7Q; Ligand: 152; 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: 1t7q.bio1) has 41 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1T7Q; Ligand: COA; 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: 1t7q.bio1) has 41 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1T7Q; Ligand: 152; 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: 1t7q.bio2) has 38 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 1T7Q; Ligand: COA; 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: 1t7q.bio2) has 38 residues
No: Leader PDB Ligand Sequence Similarity
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