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Receptor
PDB id Resolution Class Description Source Keywords
4NSQ 2.31 Å EC: 2.3.1.48 CRYSTAL STRUCTURE OF PCAF HOMO SAPIENS ACETYLTRANSFERASE COA BINDING TRANSFERASE
Ref.: DIMERIC STRUCTURE OF P300/CBP ASSOCIATED FACTOR. BMC STRUCT.BIOL. V. 14 2 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
COA B:700;
A:700;
D:700;
C:700;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
767.534 C21 H36 N7 O16 P3 S CC(C)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4NSQ 2.31 Å EC: 2.3.1.48 CRYSTAL STRUCTURE OF PCAF HOMO SAPIENS ACETYLTRANSFERASE COA BINDING TRANSFERASE
Ref.: DIMERIC STRUCTURE OF P300/CBP ASSOCIATED FACTOR. BMC STRUCT.BIOL. V. 14 2 2014
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 46 families.
1 4NSQ - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
70% Homology Family (7)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 29 families.
1 1CM0 - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
2 1QSR - ACO C23 H38 N7 O17 P3 S CC(=O)SCCN....
3 5H84 - 1VU C24 H40 N7 O17 P3 S CCC(=O)SCC....
4 1Z4R - ACO C23 H38 N7 O17 P3 S CC(=O)SCCN....
5 5TRL - SCA C25 H40 N7 O19 P3 S CC(C)(CO[P....
6 5H86 Ki = 5.6 uM BCO C25 H42 N7 O17 P3 S CCCC(=O)SC....
7 4NSQ - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
50% Homology Family (7)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 21 families.
1 1CM0 - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
2 1QSR - ACO C23 H38 N7 O17 P3 S CC(=O)SCCN....
3 5H84 - 1VU C24 H40 N7 O17 P3 S CCC(=O)SCC....
4 1Z4R - ACO C23 H38 N7 O17 P3 S CC(=O)SCCN....
5 5TRL - SCA C25 H40 N7 O19 P3 S CC(C)(CO[P....
6 5H86 Ki = 5.6 uM BCO C25 H42 N7 O17 P3 S CCCC(=O)SC....
7 4NSQ - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: COA; Similar ligands found: 211
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 AMX 0.871795 0.988235
7 30N 0.871795 0.913979
8 CAO 0.871795 0.965909
9 CMX 0.864407 0.976744
10 SCO 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 3KK 0.842975 0.977012
16 FYN 0.842975 1
17 SOP 0.836066 0.977012
18 MCD 0.836066 0.954545
19 OXK 0.836066 0.977012
20 CA6 0.836066 0.885417
21 COK 0.836066 0.977012
22 CO6 0.829268 0.977012
23 NMX 0.829268 0.903226
24 1VU 0.829268 0.965909
25 CMC 0.829268 0.977012
26 CAJ 0.822581 0.954545
27 SCD 0.822581 0.976744
28 2MC 0.822581 0.934066
29 2CP 0.81746 0.965909
30 A1S 0.816 0.977012
31 3HC 0.816 0.988372
32 IVC 0.816 0.988372
33 1HE 0.816 0.955056
34 MLC 0.816 0.977012
35 BCO 0.816 0.977012
36 COD 0.810345 0.988235
37 COO 0.809524 0.977012
38 MCA 0.809524 0.965909
39 CAA 0.809524 0.988372
40 YE1 0.809524 0.965517
41 MC4 0.80315 0.923913
42 SCA 0.80315 0.977012
43 CA8 0.796875 0.885417
44 COF 0.796875 0.955056
45 BYC 0.796875 0.977012
46 COW 0.796875 0.965909
47 3CP 0.796875 0.977012
48 IRC 0.796875 0.988372
49 1GZ 0.796875 0.965909
50 HGG 0.796875 0.977012
51 2KQ 0.796875 0.955056
52 BCA 0.790698 0.965909
53 4CA 0.790698 0.965909
54 FAQ 0.790698 0.977012
55 HXC 0.784615 0.955056
56 GRA 0.784615 0.977012
57 1CV 0.781955 0.977012
58 TGC 0.778626 0.965909
59 2NE 0.772727 0.955056
60 1CZ 0.772727 0.965909
61 CO8 0.772727 0.955056
62 S0N 0.772727 0.954545
63 CIC 0.772727 0.977012
64 DCC 0.766917 0.955056
65 UCC 0.766917 0.955056
66 0FQ 0.766917 0.977012
67 MYA 0.766917 0.955056
68 ST9 0.766917 0.955056
69 4CO 0.766917 0.965909
70 5F9 0.766917 0.955056
71 MFK 0.766917 0.955056
72 01A 0.761194 0.934066
73 0ET 0.761194 0.955056
74 WCA 0.755556 0.955056
75 CS8 0.755556 0.944444
76 UOQ 0.75 0.955056
77 NHW 0.75 0.955056
78 NHM 0.75 0.955056
79 4KX 0.75 0.944444
80 HDC 0.75 0.955056
81 MRR 0.744526 0.955056
82 MRS 0.744526 0.955056
83 HFQ 0.744526 0.955056
84 YNC 0.73913 0.965909
85 DAK 0.73913 0.944444
86 8Z2 0.733813 0.944444
87 NHQ 0.723404 0.988372
88 F8G 0.715278 0.913979
89 1HA 0.713287 0.955056
90 01K 0.708333 0.977012
91 COT 0.703448 0.977012
92 CCQ 0.695652 0.934066
93 CA3 0.693878 0.977012
94 7L1 0.692308 0.965909
95 CA5 0.671053 0.934066
96 UCA 0.666667 0.955056
97 93P 0.666667 0.965909
98 CO7 0.664234 0.977012
99 93M 0.64557 0.965909
100 OXT 0.634146 0.913979
101 5TW 0.607143 0.913979
102 4BN 0.607143 0.913979
103 PAP 0.603604 0.811765
104 JBT 0.598837 0.894737
105 BSJ 0.592814 0.944444
106 HMG 0.581081 0.943182
107 COA PLM 0.573333 0.922222
108 PLM COA 0.573333 0.922222
109 A3P 0.54955 0.8
110 PPS 0.547009 0.752688
111 ASP ASP ASP ILE CMC NH2 0.536585 0.932584
112 0WD 0.521739 0.788889
113 SFC 0.490683 0.955056
114 RFC 0.490683 0.955056
115 191 0.490196 0.865979
116 ACE SER ASP ALY THR NH2 COA 0.483333 0.932584
117 3AM 0.482143 0.788235
118 PTJ 0.48062 0.872093
119 4PS 0.477477 0.682353
120 A22 0.468254 0.813953
121 A2D 0.465517 0.802326
122 PUA 0.462585 0.820225
123 PAJ 0.460938 0.883721
124 ATR 0.459016 0.8
125 SAP 0.459016 0.806818
126 AGS 0.459016 0.806818
127 3OD 0.458015 0.825581
128 ADP 0.453782 0.823529
129 A2R 0.448819 0.813953
130 BA3 0.445378 0.802326
131 OAD 0.442748 0.825581
132 NA7 0.442748 0.858824
133 ATP 0.442623 0.823529
134 HEJ 0.442623 0.823529
135 AP5 0.441667 0.802326
136 B4P 0.441667 0.802326
137 AR6 0.439024 0.802326
138 APR 0.439024 0.802326
139 2A5 0.439024 0.847059
140 5FA 0.439024 0.823529
141 AQP 0.439024 0.823529
142 AN2 0.438017 0.813953
143 AT4 0.438017 0.816092
144 48N 0.435714 0.808989
145 M33 0.434426 0.813953
146 9X8 0.431818 0.806818
147 SRP 0.429688 0.837209
148 ANP 0.428571 0.804598
149 ADQ 0.427481 0.804598
150 YLB 0.426573 0.908046
151 YLP 0.425532 0.886364
152 5AL 0.425197 0.813953
153 7D3 0.425 0.793103
154 AD9 0.424 0.804598
155 APU 0.423611 0.786517
156 7D4 0.422764 0.793103
157 CA0 0.422764 0.804598
158 25L 0.422222 0.813953
159 ATF 0.421875 0.795455
160 F2R 0.421769 0.865169
161 NJP 0.421769 0.806818
162 A2P 0.421488 0.788235
163 A A A 0.421053 0.813953
164 8QN 0.419847 0.813953
165 PNS 0.419643 0.682353
166 ACP 0.419355 0.825581
167 NDP 0.417808 0.788889
168 ACQ 0.417323 0.825581
169 A1R 0.416667 0.882353
170 ATP A A A 0.416058 0.770115
171 A 0.415254 0.8
172 AMP 0.415254 0.8
173 1ZZ 0.414815 0.842697
174 NB8 0.414815 0.808989
175 TXA 0.414815 0.816092
176 FYA 0.414815 0.813953
177 DLL 0.413534 0.793103
178 00A 0.413534 0.758242
179 AHX 0.413534 0.829545
180 PAX 0.412903 0.793478
181 DQV 0.411348 0.813953
182 OMR 0.409722 0.853933
183 9ZD 0.409091 0.818182
184 25A 0.409091 0.802326
185 OOB 0.409091 0.793103
186 9ZA 0.409091 0.818182
187 NPW 0.408163 0.822222
188 6YZ 0.407692 0.825581
189 A A 0.407407 0.781609
190 WAQ 0.407407 0.860465
191 TAT 0.40625 0.816092
192 T99 0.40625 0.816092
193 AMO 0.406015 0.837209
194 4AD 0.406015 0.827586
195 A3R 0.406015 0.882353
196 FA5 0.405797 0.816092
197 YAP 0.405797 0.806818
198 B5Y 0.405797 0.786517
199 TXP 0.405405 0.829545
200 ABM 0.404959 0.781609
201 PRX 0.404762 0.825581
202 ME8 0.404412 0.842697
203 BIS 0.404412 0.818182
204 AFH 0.404255 0.78022
205 J7V 0.403846 0.778947
206 NAI 0.402778 0.777778
207 ODP 0.402685 0.78022
208 DAL AMP 0.401515 0.793103
209 AU1 0.4 0.804598
210 ADX 0.4 0.752688
211 SRA 0.4 0.784091
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4NSQ; Ligand: COA; Similar sites found with APoc: 260
This union binding pocket(no: 1) in the query (biounit: 4nsq.bio2) has 20 residues
No: Leader PDB Ligand Sequence Similarity
1 1XP8 AGS None
2 1N8V BDD None
3 4O4Z N2O None
4 3VPB GLU None
5 4WOP CTP None
6 1C1X HFA None
7 1BW9 PPY None
8 3R7F CP None
9 3RV5 DXC None
10 5TVI MYR None
11 4U9W COA 1.05263
12 2X7I CIT 1.57895
13 5YU3 PRO 1.57895
14 5YU3 NAD 1.57895
15 4PPF FLC 2.10526
16 2Y65 ADP 2.10526
17 3COB ADP 2.10526
18 1IYK MYA 2.10526
19 4R2I ANP 2.63158
20 1GNI OLA 2.63158
21 2ZR9 DTP 2.63158
22 2VVG ADP 2.63158
23 3TK1 GDP 2.63158
24 1YRE COA 2.63158
25 1SBR VIB 2.63158
26 3PMA SCR 2.63158
27 1FZQ GDP 2.76243
28 1F9V ADP 2.88184
29 1OCU PIB 3.08642
30 1DTL BEP 3.10559
31 3GD8 GOL 3.15789
32 2HHP FLC 3.15789
33 2CBZ ATP 3.15789
34 2PZE ATP 3.15789
35 4X8D AVI 3.15789
36 5LX9 OLB 3.15789
37 4WZ6 ATP 3.15789
38 2BP1 FLC 3.15789
39 3B5J 12D 3.15789
40 5V3Y 5V8 3.15789
41 1R0X ATP 3.15789
42 5HTX ADP 3.15789
43 1IZC PYR 3.15789
44 2NCD ADP 3.15789
45 1XMV ADP 3.15789
46 1S7N COA 3.2967
47 5JPH COA 3.47222
48 3WR7 COA 3.52941
49 5FVJ ACO 3.61446
50 1P0H COA 3.68421
51 1P0H ACO 3.68421
52 2WSA 646 3.68421
53 2WSA MYA 3.68421
54 2D2F ADP 3.68421
55 4LOC OXM 3.68421
56 1RRC ADP 3.68421
57 5GVR LMR 3.68421
58 4DE3 DN8 3.68421
59 1RQH PYR 3.68421
60 5EK3 5PK 3.68421
61 6BVM EBV 3.68421
62 6BVK EAV 3.68421
63 6BVJ EAS 3.68421
64 4YJ1 ADP 3.68421
65 6BVL EBY 3.68421
66 4AG5 ADP 3.68421
67 4R98 GNH 3.68421
68 6BVI EC4 3.68421
69 3DC4 ADP 3.68421
70 3N5C GDP 3.68421
71 2IXE ATP 3.68421
72 1ZIN AP5 3.68421
73 5W6Y TRP 3.68421
74 2B99 RDL 3.84615
75 3KPE TM3 3.92157
76 5MU6 KFK 4.21053
77 5MU6 MYA 4.21053
78 1JJ7 ADP 4.21053
79 1B0U ATP 4.21053
80 5NM7 GLY 4.21053
81 5CQG 55C 4.21053
82 1SKQ GDP 4.21053
83 1FFU CDP 4.21053
84 1WWZ ACO 4.40252
85 4UWJ 7L5 4.6683
86 4UWJ MYA 4.6683
87 2Q4V ACO 4.70588
88 2ZPA ACO 4.73684
89 4C2X NHW 4.73684
90 4WGF HX2 4.73684
91 3LRE ADP 4.73684
92 2EVL GAL SPH EIC 4.73684
93 4NON GDP 4.73684
94 1XX6 ADP 4.73684
95 4LY9 1YY 4.73684
96 5V4R MGT 4.93827
97 4CRZ ACO 5.10949
98 1M4I PAP 5.26316
99 2YNE YNE 5.26316
100 2YNE NHW 5.26316
101 6EDV COA 5.26316
102 2YNC YNC 5.26316
103 1M4I COA 5.26316
104 1M4I KAN 5.26316
105 2ZW5 COA 5.26316
106 4QC6 30N 5.26316
107 6BR8 6OU 5.26316
108 2DPY ADP 5.26316
109 2P4Y C03 5.26316
110 5E5U MLI 5.26316
111 2XT3 ADP 5.26316
112 4BTB PRO PRO PRO PRO PRO PRO PRO PRO PRO 5.26316
113 6BWL UDP 5.26316
114 5TWO 7MV 5.26316
115 3WDM ADN 5.26316
116 2X77 GDP 5.29101
117 3R96 ACO 5.31915
118 3R96 AMP 5.31915
119 1GXU 2HP 5.49451
120 5U32 GDP 5.50847
121 4AVB ACO 5.78947
122 2AWN ADP 5.78947
123 1G6H ADP 5.78947
124 3EC1 GDP 5.78947
125 1JI0 ATP 5.78947
126 2GKS ADP 5.78947
127 1LVG ADP 5.78947
128 3O9Z NAD 5.78947
129 5XDR ADP 5.78947
130 1U0J ADP 5.78947
131 3O9Z AKG 5.78947
132 6A20 ADP 5.78947
133 1JJV ATP 5.78947
134 4RI1 ACO 5.91398
135 3I6B KDO 6.11111
136 1KUV CA5 6.31579
137 4U00 ADP 6.31579
138 1T5C ADP 6.31579
139 3RC3 ANP 6.31579
140 3VSV XYP 6.31579
141 4IHQ ADP 6.31579
142 5ZXD ATP 6.31579
143 4FRZ ADP 6.31579
144 3A4M ADP 6.31579
145 4Z87 5GP 6.31579
146 6DIO CIT 6.31579
147 3TE4 ACO 6.84211
148 2WJG GDP 6.91489
149 4XCP PLM 7.05882
150 1CJW COT 7.22892
151 6G96 ACO 7.36842
152 1V0C ACO 7.36842
153 1V0C KNC 7.36842
154 4F06 PHB 7.36842
155 5UIV ADP 7.36842
156 3F3E LEU 7.36842
157 3CNL GNP 7.36842
158 1M2Z BOG 7.36842
159 4UA3 COA 7.89474
160 1W55 GPP 7.89474
161 2BCG GER 7.89474
162 3P3G 3P3 7.89474
163 3P3G UKW 7.89474
164 1N1G BCP 7.89474
165 4KOT CE3 8.02469
166 3PQC GDP 8.42105
167 5U3B 7TD 8.42105
168 2R4V GSH 8.42105
169 4YRY NAD 8.42105
170 2IS6 ADP 8.42105
171 3K9U ACO 8.80503
172 5K04 COA 8.82353
173 3ZLR X0B 8.86076
174 3W5J GDP 8.94737
175 1YQT ADP 8.94737
176 4B5P ACO 9
177 3KP6 SAL 9.27152
178 4QM7 GTP 9.35672
179 3TBK ANP 9.47368
180 5JCA NDP 9.47368
181 2QN6 GDP 9.47368
182 3F8K COA 10
183 1TV5 N8E 10
184 4UTG ANP 10
185 4YMU ATP 10
186 2WOR 2AN 10
187 4PX9 ADP 10
188 6GSG RCO 10
189 1EYQ NAR 10
190 3LN9 FLC 10.0719
191 4AG9 COA 10.303
192 3GWL FAD 10.3774
193 1IID NHM 10.5263
194 5NTP 98E 10.5263
195 2R42 FPS 10.5263
196 1OXV ANP 10.5263
197 4KVX ACO 10.8974
198 5TVJ COA 11.0526
199 3SXN COA 11.0526
200 5TVJ 7LF 11.0526
201 3NHB ADP 11.0526
202 2CDN ADP 11.0526
203 5M04 GDP 11.0526
204 3LA3 2FT 11.0526
205 5W8E SXZ 11.3122
206 5W8E ADE 11.3122
207 4H6U ACO 11.5
208 2VZZ SCA 11.5789
209 5YV5 ADP 11.5789
210 2XAU ADP 11.5789
211 4V1F BQ1 11.6279
212 5YGE ACO 12.069
213 5YGE GLU 12.069
214 2WDA L42 12.1053
215 3B6C SDN 12.1053
216 5LTJ ADP 12.1053
217 4DCT GDP 12.1053
218 4J0Q GDP 12.1053
219 5XXS COA 12.1212
220 4R57 ACO 12.5
221 2VBQ BSJ 12.7273
222 1TIQ COA 12.7778
223 3H4S ADP 13.1579
224 5HH0 COA 13.6842
225 3S6X SIA GAL BGC 13.6842
226 5AK0 8V1 13.6842
227 1I1D COA 14.2857
228 1I1D 16G 14.2857
229 1N71 COA 15.5556
230 2OG2 MLI 15.7895
231 3B9Q MLI 15.7895
232 4KFU ACP 16.3158
233 1GHE ACO 16.9492
234 5LS7 ACO 17.0732
235 2JDC CAO 17.1233
236 5TSH ADP 17.3684
237 1SVI GDP 17.3684
238 2B4D COA 18.1287
239 2B4B COA 18.1287
240 5ZCO TGL 18.3673
241 5W97 CHD 18.3673
242 4XPL ACO 18.4049
243 1RE0 GDP 18.4211
244 2JEV NHQ 18.9655
245 2IL4 COA 19.4175
246 2KIN ADP 19.4737
247 2WPW ACO 20
248 2WPX ACO 20
249 3D2M COA 20.5263
250 4OGQ 7PH 20.5882
251 4OGQ UMQ 20.5882
252 5KF9 ACO 22.1053
253 5KF9 NAG 22.1053
254 5KF9 COA 22.1053
255 2W58 ADP 22.2772
256 2CNT COA 23.75
257 1TUK PGM 23.8806
258 3ZJ0 ACO 24.2105
259 1BO4 COA 26.7857
260 4R3L COA 29.4798
Pocket No.: 2; Query (leader) PDB : 4NSQ; Ligand: COA; Similar sites found with APoc: 77
This union binding pocket(no: 2) in the query (biounit: 4nsq.bio2) has 19 residues
No: Leader PDB Ligand Sequence Similarity
1 2OBM ADP 1.57895
2 1S8F GDP 1.69492
3 5UGW GSH 1.71429
4 1L2T ATP 2.63158
5 3P4X ADP 2.63158
6 4TO8 FLC 2.63158
7 5U6C 7YS 2.63158
8 1A5Z FBP 3.15789
9 1ZGS XMM 3.15789
10 2B6N ALA PRO THR 3.15789
11 1JBW TMF 3.15789
12 2UUU FAD 3.15789
13 2UUU PL3 3.15789
14 2BIF SIN 3.68421
15 2BIF ANP 3.68421
16 1V7Z CRN 3.68421
17 1BZY IMU 4.21053
18 1I4D GDP 4.21053
19 3ZIA ADP 4.21053
20 1S3G AP5 4.21053
21 4ZKD GDP 4.21053
22 1N62 MCN 4.21053
23 4Q86 AMP 4.21053
24 1BG2 ADP 4.73684
25 2JFZ DGL 4.73684
26 2JFZ 003 4.73684
27 5G41 AP5 4.73684
28 1H9G COA MYR 4.73684
29 4LY9 S6P 4.73684
30 2IGA XX2 4.73684
31 6HKE LMR 4.73684
32 3FB4 AP5 4.73684
33 5URY PAM 4.79452
34 3FUR Z12 5.26316
35 1M7G AV2 5.26316
36 4X8O AP5 5.78947
37 1PVS 7HP 5.78947
38 6CIB ADP 5.78947
39 1G16 GDP 5.88235
40 4Z87 GDP 6.31579
41 3LLI FAD 6.31579
42 2CJW GDP 6.31579
43 6BSX E7S 6.74157
44 3ZKK XYP XYP XYP XYP 6.84211
45 5BYK A3P 6.84211
46 5BYK OAQ 6.84211
47 4LHW GNP 6.89655
48 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 7.14286
49 3RLF ANP 7.36842
50 3U6B GDP 7.36842
51 3MD0 GDP 7.89474
52 5YT0 GDP 8.42105
53 4B47 GDP 8.94737
54 6BMS POV 8.94737
55 2HT6 GDP 9.1954
56 3TDC 0EU 9.47368
57 2RGX AP5 9.47368
58 5WL1 CUY 10.101
59 5WL1 D3D 10.101
60 2IYL GDP 10.2113
61 3FVQ ATP 10.5263
62 4BFW ZVW 10.5263
63 4MKG AP5 11.0599
64 3MJY IJZ 11.5789
65 3MJY FMN 11.5789
66 1AKY AP5 12.1053
67 3KO0 TFP 12.8713
68 5Y02 MXN 14.0187
69 4CVN ADP 14.7368
70 3QCP FAD 15.2632
71 1OZH HE3 15.2632
72 3QUZ QUV 16.1616
73 5B4B LP5 16.8421
74 4MKF AP5 17.8947
75 4LYA ATP 18.4211
76 5N53 8NB 21.0526
77 5IVX ARG GLY PRO GLY ARG ALA PHE VAL THR ILE 23.6842
Pocket No.: 3; Query (leader) PDB : 4NSQ; Ligand: COA; Similar sites found with APoc: 24
This union binding pocket(no: 3) in the query (biounit: 4nsq.bio1) has 20 residues
No: Leader PDB Ligand Sequence Similarity
1 4E03 ADP None
2 3C3N FMN 2.63158
3 1GOJ ADP 3.68421
4 4HA6 PXM 3.68421
5 3KC1 2T6 4.1543
6 1UKZ ADP 4.21053
7 4Y9J FAD 4.21053
8 2C91 TLA 4.43787
9 3GJB AKG 4.70219
10 1PVN MZP 4.73684
11 1Q0S SAH 5.01931
12 5XFV FMN 5.78947
13 3WYJ H78 5.78947
14 6C0B PAM 6.31579
15 2XMY CDK 6.84211
16 2WHP HI6 6.84211
17 1S9D GDP 7.31707
18 5LXT GTP 8.39161
19 1F6B GDP 8.58586
20 4JX1 CAH 8.94737
21 3R6K FUC GAL GLA 9.47368
22 6D5X ATP 10.5263
23 1OVD FMN 13.1579
24 1OVD ORO 13.1579
Pocket No.: 4; Query (leader) PDB : 4NSQ; Ligand: COA; Similar sites found with APoc: 15
This union binding pocket(no: 4) in the query (biounit: 4nsq.bio1) has 20 residues
No: Leader PDB Ligand Sequence Similarity
1 2X1L MET 2.63158
2 1O5O U5P 2.63158
3 1Z42 FMN 3.15789
4 1JBW ACQ 3.15789
5 4WBD CIT 3.15789
6 4U8P FDA 4.21053
7 2F2G HMH 4.21053
8 2C29 DQH 4.21053
9 1ICV NIO 4.73684
10 5TCI MLI 4.73684
11 4WOH 4NP 5.42169
12 5WHU SIA 6.04027
13 3WGT FAD 7.36842
14 3SQP 3J8 11.5789
15 5OFW 9TW 21.0526
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