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Receptor
PDB id Resolution Class Description Source Keywords
3C3Y 1.37 Å EC: 2.1.1.104 CRYSTAL STRUCTURE OF PFOMT, PHENYLPROPANOID AND FLAVONOID O- METHYLTRANSFERASE FROM M. CRYSTALLINUM MESEMBRYANTHEMUM CRYSTALLINUM PLANT SECONDARY METABOLISM O-METHYLTRANSFERASE
Ref.: BIOCHEMICAL AND STRUCTURAL ANALYSIS OF SUBSTRATE PROMISCUITY IN PLANT MG(2+)-DEPENDENT O-METHYLTRANSFERASES J.MOL.BIOL. V. 378 154 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:238;
A:239;
B:238;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
submit data
40.078 Ca [Ca+2...
SAH A:464;
B:465;
Valid;
Valid;
none;
none;
submit data
384.411 C14 H20 N6 O5 S c1nc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3C3Y 1.37 Å EC: 2.1.1.104 CRYSTAL STRUCTURE OF PFOMT, PHENYLPROPANOID AND FLAVONOID O- METHYLTRANSFERASE FROM M. CRYSTALLINUM MESEMBRYANTHEMUM CRYSTALLINUM PLANT SECONDARY METABOLISM O-METHYLTRANSFERASE
Ref.: BIOCHEMICAL AND STRUCTURAL ANALYSIS OF SUBSTRATE PROMISCUITY IN PLANT MG(2+)-DEPENDENT O-METHYLTRANSFERASES J.MOL.BIOL. V. 378 154 2008
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3C3Y - SAH C14 H20 N6 O5 S c1nc(c2c(n....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3C3Y - SAH C14 H20 N6 O5 S c1nc(c2c(n....
50% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 187 families.
1 2HNK - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 5LOG - LDP C8 H11 N O2 c1cc(c(cc1....
3 3CBG - FER C10 H10 O4 COc1cc(ccc....
4 5KVA Kd = 8.6 uM SAM C15 H22 N6 O5 S C[S@@+](CC....
5 3C3Y - SAH C14 H20 N6 O5 S c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: SAH; Similar ligands found: 211
No: Ligand ECFP6 Tc MDL keys Tc
1 SAH 1 1
2 5X8 0.759494 0.969697
3 A7D 0.734177 0.926471
4 TT8 0.709302 0.970588
5 DSH 0.692308 0.914286
6 SXZ 0.692308 0.916667
7 DTA 0.666667 0.857143
8 3DH 0.662338 0.869565
9 S8M 0.655556 0.901408
10 SFG 0.635294 0.954545
11 SA8 0.62069 0.915493
12 EEM 0.617977 0.890411
13 MTA 0.615385 0.869565
14 SAI 0.613636 0.955882
15 S7M 0.586957 0.916667
16 36A 0.586538 0.90411
17 K15 0.583333 0.878378
18 ADN 0.573333 0.84058
19 RAB 0.573333 0.84058
20 XYA 0.573333 0.84058
21 62X 0.572917 0.855263
22 5CD 0.571429 0.852941
23 0UM 0.5625 0.876712
24 5N5 0.558442 0.84058
25 A4D 0.551282 0.867647
26 SAM 0.537634 0.916667
27 SMM 0.536842 0.88
28 SSA 0.536842 0.712644
29 KB1 0.534653 0.902778
30 A5D 0.532609 0.857143
31 SIB 0.53125 0.928571
32 EP4 0.530864 0.819444
33 DSZ 0.530612 0.732558
34 GSU 0.53 0.752941
35 A 0.529412 0.763158
36 LMS 0.529412 0.694118
37 AMP 0.529412 0.763158
38 5CA 0.525773 0.712644
39 ME8 0.524752 0.8125
40 M2T 0.52439 0.821918
41 6RE 0.523256 0.824324
42 GJV 0.522727 0.813333
43 AAT 0.515789 0.863014
44 LSS 0.515152 0.696629
45 KAA 0.514852 0.727273
46 J7C 0.511364 0.835616
47 A5A 0.510417 0.697674
48 SON 0.505495 0.805195
49 SRP 0.505155 0.805195
50 F0P 0.504505 0.915493
51 54H 0.5 0.681818
52 VMS 0.5 0.681818
53 ADX 0.5 0.694118
54 CA0 0.5 0.769231
55 AMO 0.5 0.805195
56 5AL 0.5 0.779221
57 KH3 0.5 0.866667
58 NVA LMS 0.49505 0.707865
59 AHX 0.49505 0.753086
60 TSB 0.494949 0.689655
61 53H 0.494949 0.674157
62 G5A 0.494737 0.712644
63 ABM 0.494382 0.74359
64 A2D 0.494382 0.74359
65 ZAS 0.494253 0.808219
66 A6D 0.490196 0.759494
67 8QN 0.49 0.779221
68 GEK 0.49 0.956522
69 GAP 0.489583 0.769231
70 AN2 0.48913 0.734177
71 A3S 0.48913 0.884058
72 S4M 0.488889 0.831169
73 SRA 0.488636 0.746835
74 LAD 0.485437 0.810127
75 52H 0.484848 0.674157
76 A12 0.483516 0.759494
77 BA3 0.483516 0.74359
78 AP2 0.483516 0.759494
79 NEC 0.483146 0.788732
80 AOC 0.483146 0.842857
81 Y3J 0.481481 0.768116
82 VRT 0.479167 0.861111
83 50T 0.478723 0.734177
84 B4P 0.478261 0.74359
85 ADP 0.478261 0.74359
86 5AS 0.478261 0.655556
87 AP5 0.478261 0.74359
88 A3N 0.477778 0.830986
89 YSA 0.476636 0.712644
90 XAH 0.476636 0.768293
91 0XU 0.473684 0.897059
92 AT4 0.473118 0.7375
93 WAQ 0.471154 0.807692
94 NSS 0.470588 0.712644
95 5AD 0.468354 0.791045
96 AU1 0.468085 0.725
97 M33 0.468085 0.734177
98 MAO 0.467391 0.797468
99 TXA 0.466667 0.759494
100 NB8 0.466667 0.775
101 A3G 0.466667 0.871429
102 3AM 0.465909 0.727273
103 DAL AMP 0.465347 0.779221
104 8X1 0.465347 0.707865
105 A3T 0.463158 0.842857
106 ATP 0.463158 0.74359
107 HEJ 0.463158 0.74359
108 ACP 0.463158 0.746835
109 7D7 0.4625 0.785714
110 LEU LMS 0.461538 0.688889
111 9ZA 0.460784 0.740741
112 9ZD 0.460784 0.740741
113 5FA 0.458333 0.74359
114 AQP 0.458333 0.74359
115 AR6 0.458333 0.766234
116 APC 0.458333 0.759494
117 APR 0.458333 0.766234
118 PRX 0.458333 0.746835
119 F2R 0.457627 0.75
120 IOT 0.456897 0.761905
121 4AD 0.456311 0.794872
122 PAJ 0.456311 0.722892
123 WSA 0.45614 0.72093
124 YAP 0.453704 0.794872
125 8PZ 0.453704 0.712644
126 FA5 0.453704 0.805195
127 ADP PO3 0.453608 0.763158
128 ADV 0.453608 0.782051
129 NVA 2AD 0.453608 0.849315
130 SAP 0.453608 0.728395
131 AGS 0.453608 0.728395
132 RBY 0.453608 0.782051
133 AD9 0.453608 0.725
134 PTJ 0.45283 0.731707
135 MHZ 0.452632 0.797468
136 00A 0.451923 0.740741
137 A3P 0.451613 0.74026
138 YLP 0.451327 0.771084
139 7MD 0.45045 0.768293
140 ALF ADP 0.45 0.707317
141 ADP ALF 0.45 0.707317
142 2VA 0.447917 0.819444
143 OOB 0.446602 0.779221
144 ANP 0.444444 0.725
145 T99 0.444444 0.7375
146 ACQ 0.444444 0.746835
147 TAT 0.444444 0.7375
148 P5A 0.443396 0.719101
149 7D5 0.443182 0.708861
150 A1R 0.442308 0.7625
151 YLC 0.439655 0.790123
152 2AM 0.438202 0.717949
153 DLL 0.438095 0.779221
154 ARG AMP 0.4375 0.759036
155 A22 0.436893 0.734177
156 D3Y 0.436893 0.859155
157 ATF 0.435644 0.716049
158 MYR AMP 0.435185 0.746988
159 80F 0.434426 0.75
160 SO8 0.434343 0.808219
161 OAD 0.433962 0.769231
162 3UK 0.433962 0.769231
163 TAD 0.433628 0.765432
164 25A 0.432692 0.74359
165 6YZ 0.431373 0.746835
166 VO4 ADP 0.431373 0.734177
167 ADP VO4 0.431373 0.734177
168 9SN 0.431193 0.731707
169 TYM 0.431034 0.805195
170 B5V 0.429907 0.759494
171 PR8 0.429907 0.8
172 ADQ 0.428571 0.746835
173 YLB 0.42735 0.771084
174 9K8 0.425926 0.67033
175 1ZZ 0.425926 0.746988
176 FYA 0.425926 0.779221
177 3OD 0.425926 0.769231
178 PPS 0.425743 0.674419
179 MAP 0.423077 0.707317
180 A2P 0.421053 0.727273
181 4YB 0.421053 0.735632
182 9X8 0.420561 0.75
183 ADP BMA 0.420561 0.746835
184 TYR AMP 0.419643 0.794872
185 5SV 0.419048 0.731707
186 3NZ 0.416667 0.824324
187 YLA 0.416667 0.771084
188 8Q2 0.415254 0.688889
189 A3R 0.415094 0.7625
190 B5Y 0.414414 0.75
191 B5M 0.414414 0.75
192 48N 0.413793 0.753086
193 LPA AMP 0.413793 0.768293
194 AYB 0.413223 0.761905
195 ACK 0.413043 0.710526
196 QQY 0.413043 0.696203
197 BIS 0.412844 0.719512
198 JB6 0.412844 0.7625
199 PAP 0.41 0.730769
200 DQV 0.408696 0.75641
201 OVE 0.408602 0.7125
202 AMP DBH 0.40708 0.746835
203 4UV 0.40708 0.75
204 3AD 0.406977 0.852941
205 AF3 ADP 3PG 0.40678 0.743902
206 OMR 0.40678 0.738095
207 LAQ 0.405172 0.768293
208 A A 0.40367 0.74359
209 7C5 0.403509 0.789474
210 7MC 0.403361 0.75
211 4UU 0.4 0.75
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3C3Y; Ligand: SAH; Similar sites found with APoc: 840
This union binding pocket(no: 1) in the query (biounit: 3c3y.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
1 3FUU ADN None
2 3G89 SAM None
3 6EL3 NAP 0.843882
4 5GVR LMR 0.854701
5 1G55 SAH 1.26582
6 1RSG FAD 1.26582
7 4FN4 NAD 1.26582
8 2Q0L FAD 1.26582
9 5BSZ SAH 1.26582
10 3FRH SAH 1.26582
11 4BUZ OCZ 1.26582
12 4BUZ OAD 1.26582
13 4BUZ NAD 1.26582
14 1VE3 SAM 1.32159
15 5IL1 SAM 1.68776
16 3EVF SAH 1.68776
17 3EVF GTA 1.68776
18 5K7U SAM 1.68776
19 1XHC FAD 1.68776
20 4R6W PC 1.68776
21 1GET FAD 1.68776
22 1GET NAP 1.68776
23 4R6W SAH 1.68776
24 2BD0 NAP 1.68776
25 1GR0 NAD 1.68776
26 1OAA OAA 1.68776
27 1U7T TDT 1.68776
28 4RVG TYD 1.68776
29 4RVG SAM 1.68776
30 1LTH NAD 1.68776
31 1WY7 SAH 1.93237
32 3UIE ANP 2
33 2PX8 SAH 2.1097
34 5E72 SAM 2.1097
35 4M37 SAH 2.1097
36 4M38 SAH 2.1097
37 3LAD FAD 2.1097
38 4N49 SAM 2.1097
39 5GSN FAD 2.1097
40 5GSN NAP 2.1097
41 4YAG NAI 2.1097
42 5GSN MMZ 2.1097
43 2EG5 SAH 2.1097
44 5BJX NAD 2.1097
45 5BJX UDP 2.1097
46 3G2O SAM 2.1097
47 3AB1 FAD 2.1097
48 2QA1 FAD 2.1097
49 4TQG NDP 2.1097
50 3O7W SAM 2.1097
51 5MZI FYK 2.1097
52 4YAC NAI 2.1097
53 1XG5 NAP 2.1097
54 1XHL NDP 2.1097
55 2NXE SAM 2.1097
56 4ZVV NAD 2.1097
57 5Y77 FAD 2.1097
58 3NJ4 NAD 2.1097
59 4ZVV GN0 2.1097
60 3NKS FAD 2.1097
61 4CQM NAP 2.1097
62 3RKR NAP 2.1097
63 5X62 SAH 2.1097
64 5XNC MTA 2.1097
65 1R0X ATP 2.1097
66 1T26 GBD 2.1097
67 1T26 NAI 2.1097
68 1FL2 FAD 2.1097
69 1X7D ORN 2.1097
70 2VVL FAD 2.1097
71 4XAQ 40F 2.1097
72 1E6W NAD 2.1097
73 5LQ8 GB 2.1097
74 1X7D NAD 2.1097
75 1J0X NAD 2.1097
76 1E3W NAD 2.1097
77 4WZ6 ATP 2.1097
78 1HYH NAD 2.1097
79 1CER NAD 2.1097
80 2BZG SAH 2.15517
81 2PZE ATP 2.18341
82 5FA8 SAM 2.48447
83 2PWY SAH 2.53165
84 1I9G SAM 2.53165
85 4UCI SAM 2.53165
86 4DDY DN6 2.53165
87 3GRU AMP 2.53165
88 1N2X SAM 2.53165
89 3DMH SAM 2.53165
90 3MBI HSX 2.53165
91 5FUB SAH 2.53165
92 5J5Z FAD 2.53165
93 5DLY 5D7 2.53165
94 5DLY SAH 2.53165
95 1COY FAD 2.53165
96 1GEG NAD 2.53165
97 3D3W NAP 2.53165
98 1PR9 NAP 2.53165
99 1ZGA SAH 2.53165
100 4E70 N7I 2.53165
101 6ECW SAH 2.53165
102 6A20 ADP 2.53165
103 3DMH GMP 2.53165
104 3X0V FAD 2.53165
105 6BWL NAD 2.53165
106 1PZG A3D 2.53165
107 4DE3 DN8 2.53165
108 2A92 NAI 2.53165
109 5U19 827 2.53165
110 5U19 SAH 2.53165
111 6ECU SAH 2.53165
112 4PLG OXM 2.53165
113 4PLG NAI 2.53165
114 3LST SAH 2.53165
115 1AE1 NAP 2.53165
116 1LDN NAD 2.53165
117 1KPG SAH 2.53165
118 1UPF URF 2.67857
119 2PXX SAH 2.7907
120 2JHP SAH 2.95359
121 3TKA SAM 2.95359
122 6ER9 FAD 2.95359
123 6ER9 NAP 2.95359
124 4BLW AMP 2.95359
125 3UCL NAP 2.95359
126 3UCL FAD 2.95359
127 3UCL CYH 2.95359
128 3HDY FAD 2.95359
129 3HDY FDA 2.95359
130 3HDY GDU 2.95359
131 5E1M SAH 2.95359
132 5E1M PRO PRO LYS ARG ILE ALA 2.95359
133 4XQC 13D 2.95359
134 4XQC NAD 2.95359
135 5XWV NDP 2.95359
136 6AR9 3L4 2.95359
137 1UAY ADN 2.95359
138 5BRT CH9 2.95359
139 5BRT FAD 2.95359
140 5XWV 8H6 2.95359
141 2UYQ SAM 2.95359
142 4X9M FAD 2.95359
143 3ABI NAD 2.95359
144 2WSB NAD 2.95359
145 3IHG FAD 2.95359
146 1ZQ9 SAM 2.95359
147 3GDN FAD 2.95359
148 2XT3 ADP 2.95359
149 6DNT NAD 2.95359
150 3QJ4 FAD 2.95359
151 5EB4 FAD 2.95359
152 3GDN HBX 2.95359
153 6GAS FAD 2.95359
154 5UR0 NAD 2.95359
155 2VVG ADP 2.95359
156 2IID PHE 2.95359
157 2IID FAD 2.95359
158 4BLW SAH 2.95359
159 6C8R SAH 2.95359
160 1GY8 NAD 2.95359
161 6AYU F6P 2.95359
162 6C8R EQV 2.95359
163 1T5C ADP 2.95359
164 1BC5 SAH 2.95359
165 5ICE SAH 2.95359
166 5ICE 2H4 2.95359
167 4D7E FAD 2.95359
168 5EJ2 NAD 2.95359
169 1S7G APR 2.95359
170 2AOT SAH 2.95359
171 6CI9 NAP 2.95359
172 5TOW ADN 2.95359
173 5TOW NAI 2.95359
174 1QK3 5GP 3.00429
175 4NEC SAH 3.0303
176 1G8S MET 3.04348
177 2ZL4 ALA ALA ALA ALA 3.06122
178 5Z21 NAI 3.07263
179 2FXV 5GP 3.09278
180 1RZ1 NAD 3.10559
181 6DUB SAH 3.15315
182 2VT3 ATP 3.25581
183 1HGX 5GP 3.27869
184 1V6A TRE 3.37553
185 4DCM SAM 3.37553
186 1G60 SAM 3.37553
187 4M73 M72 3.37553
188 4M73 SAH 3.37553
189 4KIB SAH 3.37553
190 3COB ADP 3.37553
191 2XVF FAD 3.37553
192 2XVE FAD 3.37553
193 2HQM FAD 3.37553
194 4D04 FAD 3.37553
195 4D04 NAP 3.37553
196 4KRI SAH 3.37553
197 4RPL 3UC 3.37553
198 4RPL FAD 3.37553
199 2C5A NAD 3.37553
200 2C5A GDC 3.37553
201 4LWP SAH 3.37553
202 1KYQ NAD 3.37553
203 4D5G TPP 3.37553
204 4D5G FAD 3.37553
205 1P4A PCP 3.37553
206 5TUF FAD 3.37553
207 4YRY NAD 3.37553
208 1PN0 FAD 3.37553
209 1PN0 IPH 3.37553
210 4YRY FAD 3.37553
211 2IVD FAD 3.37553
212 3SJU NDP 3.37553
213 5TUF TDC 3.37553
214 4FRZ ADP 3.37553
215 5GM1 SAH 3.37553
216 2JAH NDP 3.37553
217 1FK8 NAD 3.37553
218 5W7M SAH 3.37553
219 1KYZ SAH 3.37553
220 6B92 SAH 3.37553
221 4JNA FAD 3.37553
222 1X14 NAD 3.37553
223 4ZA2 NAD 3.37553
224 2JAP NDP 3.37553
225 5DN9 NAD 3.37553
226 3DC4 ADP 3.37553
227 1PJS NAD 3.37553
228 1P77 ATR 3.37553
229 3ITJ FAD 3.37553
230 2BGM NAJ 3.37553
231 1EDO NAP 3.37553
232 6GFK SAH 3.37553
233 5DF1 58X 3.37553
234 5DF1 NAP 3.37553
235 2PZM NAD 3.37553
236 2PZM UDP 3.37553
237 1DSS NAD 3.37553
238 2DC1 NAD 3.38983
239 4BQS ADP 3.40909
240 4J56 FAD 3.50877
241 4QM7 GTP 3.50877
242 1QAN SAH 3.79747
243 3QOX SAH 3.79747
244 5ULP KB1 3.79747
245 3VSE SAH 3.79747
246 5MW4 5JU 3.79747
247 5KOK SAH 3.79747
248 5KOK S9T 3.79747
249 1D4D FAD 3.79747
250 1U2Z SAH 3.79747
251 2WPF WPF 3.79747
252 2WPF FAD 3.79747
253 5KOK R9T 3.79747
254 1BZL FAD 3.79747
255 2O07 SPD 3.79747
256 2O07 MTA 3.79747
257 1QO8 FAD 3.79747
258 4IV9 FAD 3.79747
259 5GWT SIN 3.79747
260 5GWT NAD 3.79747
261 3ICS FAD 3.79747
262 3RFV 15L 3.79747
263 3ICT FAD 3.79747
264 1EK6 UPG 3.79747
265 3ICR FAD 3.79747
266 6FHO FAD 3.79747
267 5O42 NAD 3.79747
268 5O42 9JW 3.79747
269 5O42 BGC 3.79747
270 3NYC IAR 3.79747
271 3NYC FAD 3.79747
272 3RFV NAI 3.79747
273 6GKV SAH 3.79747
274 5HJM MTA 3.79747
275 3ICS ADP 3.79747
276 4KCT FDP 3.79747
277 3ICT ADP 3.79747
278 1UDB NAD 3.79747
279 1UDB UFG 3.79747
280 9LDB NAD 3.79747
281 2ZWA SAH 3.79747
282 1EK6 NAI 3.79747
283 5FTW SAH 3.79747
284 2EFJ SAH 3.79747
285 2B4Q NAP 3.79747
286 4ITU NAI 3.79747
287 4ITU 1HS 3.79747
288 5J60 FAD 3.79747
289 5DNK SAH 3.79747
290 1BXK NAD 3.79747
291 9LDT NAD 3.79747
292 6CEP NAD 3.79747
293 6CEP OXM 3.79747
294 2PD4 NAD 3.79747
295 1L1E SAH 3.79747
296 2VHW NAI 3.79747
297 3V1Y NAD 3.79747
298 1V8B NAD 3.79747
299 2PD4 DCN 3.79747
300 1ZBQ NAD 3.79747
301 1E5Q NDP 3.79747
302 3H9E NAD 3.79747
303 1DQN IMU 3.91304
304 2DPM SAM 4.21941
305 4FZV SAM 4.21941
306 3A4T SFG 4.21941
307 3TLJ SAH 4.21941
308 1PS9 FAD 4.21941
309 4MO2 FDA 4.21941
310 4PIO AVI 4.21941
311 4PIO SAH 4.21941
312 1WD4 AHR 4.21941
313 2AWN ADP 4.21941
314 4MO2 FAD 4.21941
315 6ARJ BW4 4.21941
316 4NBU NAI 4.21941
317 6F97 FAD 4.21941
318 6ARJ SAH 4.21941
319 5FWA J7C 4.21941
320 1LVL FAD 4.21941
321 1I8T FAD 4.21941
322 3AYI FAD 4.21941
323 3AYI HCI 4.21941
324 2E5V FAD 4.21941
325 4J7U YTZ 4.21941
326 5JCA FAD 4.21941
327 2YVF NAD 4.21941
328 2YVF FAD 4.21941
329 1Z6Z NAP 4.21941
330 1REO FAD 4.21941
331 4J7U NAP 4.21941
332 1J5P NAD 4.21941
333 1LVL NAD 4.21941
334 5TS5 FAD 4.21941
335 2CBZ ATP 4.21941
336 4TM3 FAD 4.21941
337 3LXD FAD 4.21941
338 4XAR 40F 4.21941
339 5JCA NDP 4.21941
340 5DXA SFG 4.21941
341 2YVJ FAD 4.21941
342 4Z24 FAD 4.21941
343 5DX8 SFG 4.21941
344 3T31 DCQ 4.21941
345 3T31 FAD 4.21941
346 5DX1 SFG 4.21941
347 1KEW NAD 4.21941
348 5DWQ SFG 4.21941
349 2AG5 NAD 4.21941
350 3ZFD ANP 4.21941
351 3A25 SAM 4.21941
352 1KEW TYD 4.21941
353 3CIF NAD 4.21941
354 5MLR NAP 4.21941
355 5MLR GRQ 4.21941
356 5Z2L NDP 4.21941
357 3KO8 NAD 4.21941
358 5DX0 SFG 4.21941
359 3CIF G3H 4.21941
360 1D1T NAD 4.21941
361 5ZZ6 ADP 4.32692
362 5ZZ6 NAD 4.32692
363 6F5Z SAH 4.329
364 2PS1 ORO 4.42478
365 2PS1 PRP 4.42478
366 2JBH 5GP 4.44444
367 1NV8 SAM 4.57746
368 1NV8 MEQ 4.57746
369 1ORR NAD 4.61095
370 5IXB LGA 4.62963
371 2WA2 SAM 4.64135
372 3ELW SAM 4.64135
373 3ELW GP3 4.64135
374 1Z3C SA8 4.64135
375 4L2I FAD 4.64135
376 1E1M FAD 4.64135
377 1E1M NAP 4.64135
378 4NTD FAD 4.64135
379 3S5W FAD 4.64135
380 1Q1R FAD 4.64135
381 4EIP FAD 4.64135
382 1F8G NAD 4.64135
383 3E1T FAD 4.64135
384 5MIT NAP 4.64135
385 5MIT FAD 4.64135
386 1GPE FAD 4.64135
387 5BW4 SAM 4.64135
388 1RM0 D6P 4.64135
389 1RM0 NAI 4.64135
390 3QVP FAD 4.64135
391 5K0A FAD 4.64135
392 4Z0H NAD 4.64135
393 2IOY RIP 4.64135
394 5MBX FAD 4.64135
395 5MBX SP5 4.64135
396 1QG6 TCL 4.64135
397 1QG6 NAD 4.64135
398 2B9W FAD 4.64135
399 1YXM ADE 4.64135
400 3HQP FDP 4.64135
401 3TN7 NJP 4.64135
402 1R6D DAU 4.64135
403 1R6D NAD 4.64135
404 4O1M NAD 4.64135
405 5L2M 6ZY 4.64135
406 1RKX NAD 4.64135
407 1MZV AMP 4.68085
408 5WHU SIA GAL GLC 4.69799
409 5VJN IR8 4.81283
410 5VJN ADE 4.81283
411 1Q0S SAH 5.06329
412 4X7Y SAH 5.06329
413 1SQF SAM 5.06329
414 2P41 SAH 5.06329
415 2JJQ SAH 5.06329
416 1JQ3 AAT 5.06329
417 4AP3 NAP 5.06329
418 4AP3 FAD 5.06329
419 1WG8 SAM 5.06329
420 4EMJ FAD 5.06329
421 2GDZ NAD 5.06329
422 2EWM NAD 5.06329
423 1RP0 AHZ 5.06329
424 5U8U FAD 5.06329
425 5KMS NAD 5.06329
426 4YSX FAD 5.06329
427 2Z3Y F2N 5.06329
428 4B63 FAD 5.06329
429 4B63 NAP 5.06329
430 4B63 ORN 5.06329
431 6AIN FAD 5.06329
432 5KMS FAD 5.06329
433 1V5F FAD 5.06329
434 1V5F TPP 5.06329
435 4USQ FAD 5.06329
436 1H82 FAD 5.06329
437 2KIN ADP 5.06329
438 5YJI SAH 5.06329
439 1H82 GZZ 5.06329
440 2WHX ADP 5.06329
441 1YQT ADP 5.06329
442 1ZK4 AC0 5.06329
443 1ZK4 NAP 5.06329
444 1QB7 ADE 5.08475
445 3GWZ SAH 5.42005
446 5THY SAH 5.48523
447 3FPF TNA 5.48523
448 3FPF MTA 5.48523
449 3S1S SAH 5.48523
450 4X60 3XV 5.48523
451 4X60 SFG 5.48523
452 4GQB 0XU 5.48523
453 5TWB FAD 5.48523
454 3AKI AH8 5.48523
455 2OOR NAD 5.48523
456 2DKH FAD 5.48523
457 2DKH 3HB 5.48523
458 6GAR FAD 5.48523
459 4GKV NAD 5.48523
460 4YNU LGC 5.48523
461 4YNU FAD 5.48523
462 5HSA FAS 5.48523
463 1IY8 NAD 5.48523
464 5YJF 8WO 5.48523
465 5YJF SAH 5.48523
466 2Q1W NAD 5.48523
467 5FA5 MTA 5.48523
468 4PLT OXM 5.48523
469 4PLT NAI 5.48523
470 1B0U ATP 5.48523
471 5F2K SAH 5.48523
472 5F2K OCA 5.48523
473 1L7E NAI 5.48523
474 5TTJ FAD 5.48523
475 2OBF SAH 5.48523
476 2OBF F83 5.48523
477 1XVB BBU 5.48523
478 3WV8 ATP 5.50459
479 2HMT NAI 5.55556
480 1P19 IMP 5.88235
481 3MAG SAH 5.90717
482 3MCT SAH 5.90717
483 5E9W SAH 5.90717
484 5E8J SAH 5.90717
485 4C4A SAH 5.90717
486 1YQZ FAD 5.90717
487 3UOY FAD 5.90717
488 3UOY NAP 5.90717
489 3GF4 FAD 5.90717
490 2Q7V FAD 5.90717
491 1JJ7 ADP 5.90717
492 3GF4 UPG 5.90717
493 3GEG NAD 5.90717
494 4OBW SAM 5.90717
495 2Q28 ADP 5.90717
496 6H3O FAD 5.90717
497 4K26 SFF 5.90717
498 4K26 NDP 5.90717
499 4Q9N NAI 5.90717
500 1Y8Q ATP 5.90717
501 3LRE ADP 5.90717
502 2Y6Q FAD 5.90717
503 4DSG FAD 5.90717
504 4DSG UDP 5.90717
505 2Y65 ADP 5.90717
506 3LU1 NAD 5.90717
507 5KOX FAD 5.90717
508 5KOX RFP 5.90717
509 5GT9 NAP 5.90717
510 2Y6Q I7T 5.90717
511 3A27 SAM 5.90717
512 5OVK NDP 5.90717
513 3GMB FAD 5.90717
514 4G5H UD7 5.90717
515 4G5H NAP 5.90717
516 1XSE NDP 5.90717
517 2V6G NAP 5.90717
518 4JLS 3ZE 5.92105
519 3H4S ADP 5.92593
520 2W58 ADP 5.94059
521 3DXY SAM 5.9633
522 4P83 U5P 6.04396
523 3ACC 5GP 6.07735
524 1EJ0 SAM 6.11111
525 3GDH SAH 6.32911
526 2ZIF SAM 6.32911
527 3LKZ SFG 6.32911
528 5UFN SAH 6.32911
529 3KLJ FAD 6.32911
530 2C7G FAD 6.32911
531 4Y30 49L 6.32911
532 4Y30 SAH 6.32911
533 1Z45 NAD 6.32911
534 3OND NAD 6.32911
535 3OND ADN 6.32911
536 3U4C NDP 6.32911
537 4HSU FAD 6.32911
538 4GUS FAD 6.32911
539 4FWE FAD 6.32911
540 4ZRN UPG 6.32911
541 4ZRN NAD 6.32911
542 4GUT FAD 6.32911
543 1FEC FAD 6.32911
544 2ZXI FAD 6.32911
545 1BG2 ADP 6.32911
546 4USR FAD 6.32911
547 4J1Q NDP 6.32911
548 1SOW NAD 6.32911
549 4URF NAD 6.32911
550 1E8G FAD 6.32911
551 1E8G FCR 6.32911
552 3O03 NAP 6.32911
553 3Q87 SAM 6.4
554 1PZM 5GP 6.63507
555 5CUQ NSC 6.75105
556 5JJR SAH 6.75105
557 2CDU FAD 6.75105
558 4U00 ADP 6.75105
559 2DTX BMA 6.75105
560 2CDU ADP 6.75105
561 1F3L SAH 6.75105
562 4KGD FAD 6.75105
563 4KGD TDP 6.75105
564 5Z75 NAD 6.75105
565 5M67 3D1 6.75105
566 5OC1 FAD 6.75105
567 5M67 ADE 6.75105
568 5M67 NAD 6.75105
569 1F9V ADP 6.75105
570 1VKO NAD 6.75105
571 1NM5 NAD 6.89655
572 1E6E FAD 7.03125
573 5WP5 SAH 7.173
574 6BQ6 TER 7.173
575 2GVC FAD 7.173
576 2GV8 FAD 7.173
577 5DM1 5D7 7.173
578 5DM1 SAH 7.173
579 1VQW FAD 7.173
580 1IM8 SAI 7.173
581 4HXY NDP 7.173
582 3FPZ AHZ 7.173
583 5GWX SAR 7.173
584 5GWX SAM 7.173
585 4REP FAD 7.173
586 5NA1 FAD 7.173
587 4RW3 DKA 7.173
588 1RJD SAM 7.173
589 1XTP SAI 7.173
590 2YG3 FAD 7.173
591 5BUK FAD 7.173
592 2D2F ADP 7.173
593 1UP7 NAD 7.173
594 2FR1 NDP 7.173
595 1RYI FAD 7.173
596 2B4R NAD 7.173
597 1O5O U5P 7.23982
598 3EGI ADP 7.28155
599 4CVN ADP 7.32984
600 2JKY 5GP 7.51174
601 2XVM SAH 7.53769
602 6FDF SAH 7.59494
603 2WK1 SAH 7.59494
604 5MPT SAH 7.59494
605 3L9W AMP 7.59494
606 3L9W GSH 7.59494
607 4ONQ SFG 7.59494
608 1X87 NAD 7.59494
609 1BDB NAD 7.59494
610 5ZYN FAD 7.59494
611 5WP4 SAH 7.59494
612 4U8P FDA 7.59494
613 4U8P UDP 7.59494
614 1ELI PYC 7.59494
615 1KNR FAD 7.59494
616 3CGB FAD 7.59494
617 3WGT FAD 7.59494
618 3WGT QSC 7.59494
619 1SB8 NAD 7.59494
620 1SB8 UD2 7.59494
621 4OHU NAD 7.59494
622 4OHU 2TK 7.59494
623 6B5G NAD 7.59494
624 6B5G CQY 7.59494
625 3A4V PYR 7.59494
626 3A4V NAD 7.59494
627 4P86 5GP 7.65027
628 1XCL SAH 7.65957
629 1LSS NAD 7.85714
630 5ERG SAM 8.01688
631 3GCZ SAM 8.01688
632 5THZ SAH 8.01688
633 1V59 FAD 8.01688
634 1ZK7 FAD 8.01688
635 3BXO SAM 8.01688
636 2IZ1 ATR 8.01688
637 4OPC FDA 8.01688
638 4OPC PGT 8.01688
639 1V59 NAD 8.01688
640 2ZJ1 NAD 8.01688
641 2ZJ1 ARJ 8.01688
642 4C3Y ANB 8.01688
643 4C3Y FAD 8.01688
644 3OZ2 FAD 8.01688
645 3K7M FAD 8.01688
646 5W8X UDP 8.01688
647 3LCV SAM 8.01688
648 3U31 NAD 8.01688
649 1GTE FAD 8.01688
650 1NU4 MLA 8.24742
651 4TXI FAD 8.43882
652 2BRY FAD 8.43882
653 3VC1 SAH 8.43882
654 3VC1 GST 8.43882
655 5W7K SAH 8.43882
656 2JB2 PHE 8.43882
657 2JB2 FAD 8.43882
658 6FP4 E1T 8.43882
659 1YKJ PHB 8.43882
660 1YKJ FAD 8.43882
661 1MJT NAD 8.43882
662 4RSL FAD 8.43882
663 3VZS NAP 8.56031
664 3LN9 FLC 8.63309
665 3OU2 SAH 8.7156
666 3PT9 SAH 8.86076
667 3EVG SAH 8.86076
668 4EUE NAI 8.86076
669 3ZV6 NAD 8.86076
670 3ZV6 4HB 8.86076
671 4J36 FAD 8.86076
672 4J36 1HR 8.86076
673 3CH6 NAP 8.86076
674 3CH6 311 8.86076
675 2C31 ADP 8.86076
676 2C31 TZD 8.86076
677 1XKQ NDP 8.86076
678 3OZG SSI 8.86076
679 3G5S FAD 8.86076
680 3CTY FAD 8.86076
681 1VL8 NAP 8.98876
682 1P1C SAH 9.04523
683 1XTT U5P 9.25926
684 6APV 3L4 9.25926
685 1RRC ADP 9.2827
686 4CNK FAD 9.2827
687 5X68 FAD 9.2827
688 4YKG FAD 9.2827
689 4YKG NAD 9.2827
690 6ECT SAM 9.2827
691 3NUG NAD 9.31174
692 3SSO SAH 9.70464
693 5JE0 SAH 9.70464
694 5JE0 AZ8 9.70464
695 1EFV FAD 9.70464
696 1EFV AMP 9.70464
697 3TKY SAH 9.70464
698 2NPX FAD 9.70464
699 2NPX NAD 9.70464
700 1ZEM NAD 9.70464
701 1C1X NAD 9.70464
702 3H5N ATP 9.70464
703 5DT6 GLU 9.70464
704 1BW9 NAD 9.70464
705 2NVK NAP 9.70464
706 2NVK FAD 9.70464
707 5YF1 SFG 9.70464
708 2HJR APR 9.70464
709 1BXG NAD 9.70464
710 1NFQ NAI 9.70464
711 3H2B SAH 9.85222
712 3VYW SAM 10.1266
713 1UWK URO 10.1266
714 1UWK NAD 10.1266
715 1G6H ADP 10.1266
716 4MIG G3F 10.1266
717 3T7S SAM 10.1266
718 2YY7 NAD 10.1266
719 4M3P HCS 10.1266
720 4K5S PM0 10.1266
721 4K5S FAD 10.1266
722 1M2K APR 10.1266
723 3V1U NAD 10.1266
724 1I1N SAH 10.177
725 4QTU SAM 10.3704
726 4DMG SAM 10.5485
727 1NW5 SAM 10.5485
728 3AD8 NAD 10.5485
729 2GAG NAD 10.5485
730 5NMX FAD 10.5485
731 5F8F SFG 10.5485
732 5NMX NAP 10.5485
733 5YEC ATP 10.5485
734 2IXB A2G 10.5485
735 2IXB NAD 10.5485
736 2RGO FAD 10.5485
737 1YBH FAD 10.5485
738 5THQ NDP 10.5485
739 3K7S R52 10.6145
740 3H8V ATP 10.6164
741 2XYQ SAH 10.6557
742 2F5Z FAD 10.9375
743 1O97 AMP 10.9705
744 1O97 FAD 10.9705
745 3AXB PRO 10.9705
746 3AXB FAD 10.9705
747 1FP1 SAH 10.9705
748 2VDV SAM 10.9705
749 3BGD SAH 10.9705
750 2GN4 NDP 10.9705
751 3BGD PM6 10.9705
752 2GN4 UD1 10.9705
753 3OFK SAH 11.1111
754 1GOJ ADP 11.3924
755 6C5B SAH 11.3924
756 3EYA FAD 11.3924
757 5N6C NAD 11.3924
758 4POO SAM 11.5
759 3C6K SPD 11.8143
760 2RAB NAD 11.8143
761 3C6K MTA 11.8143
762 2RAB FAD 11.8143
763 5JAQ NAI 11.8143
764 4JDR FAD 11.8143
765 4Y9D NAI 11.8143
766 4PNE SAH 11.8143
767 2VVM FAD 11.8143
768 2DT5 NAD 11.8483
769 4KRG SAH 12.2363
770 3M6W SAM 12.2363
771 5ODQ FAD 12.2363
772 2ZFU SAH 12.5581
773 3Q9T FAY 12.6582
774 6F9Q NAD 12.6582
775 4BV6 FAD 12.6582
776 3GD4 NAD 12.6582
777 3GD4 FAD 12.6582
778 1JNR FAD 12.6667
779 3GGO ENO 13.0802
780 3GGO NAI 13.0802
781 3P9C SAH 13.0802
782 2G5C NAD 13.0802
783 3FIU POP 13.0802
784 5T2U NAP 13.0802
785 3JWH SAH 13.3641
786 1MO9 FAD 13.5021
787 1MO9 KPC 13.5021
788 3X0D SAH 13.5021
789 4NBW NAD 13.5021
790 1E3I CXF 13.9241
791 1C4Q GLA GAL BGC 14.4928
792 2YX1 SFG 14.7679
793 5WGR FAD 14.7679
794 1DJN ADP 15.1899
795 1O94 ADP 15.1899
796 4YUW 4JU 15.6118
797 4YUW S4M 15.6118
798 4IWN GEK 15.7205
799 3VPH NAD 16.0338
800 3VPH OXM 16.0338
801 5L95 AMP 16.25
802 2PT9 2MH 16.4557
803 2I7C AAT 16.4557
804 2PT9 S4M 16.4557
805 1EU1 MGD 16.8776
806 2EJU SAH 17.2996
807 4M52 FAD 17.2996
808 4D42 W0I 17.2996
809 4D42 NAP 17.2996
810 3GU3 SAH 17.7215
811 6D6Y SAH 18.1435
812 1YY5 FAD 18.1435
813 1L3I SAH 18.2292
814 1DL5 SAH 18.5654
815 6F7L FAD 18.5654
816 1GZ6 NAI 18.5654
817 3K0T BGC 18.8811
818 5VN0 NAI 18.9873
819 5VN0 FAD 18.9873
820 3LZW FAD 18.9873
821 3LZW NAP 18.9873
822 4II2 ATP 19.2771
823 1LLU NAD 20.2532
824 3MB5 SAM 20.6751
825 4RDH AMP 22.7848
826 5G3U FDA 22.7848
827 5G3U ITW 22.7848
828 4RDI ATP 22.7848
829 4D79 ATP 22.7848
830 5ZBC FAD 22.7848
831 1R18 SAH 25.1101
832 1XXA ARG 29.4872
833 3HVJ 705 30.7692
834 1JG3 ADN 34.1772
835 4XUC SAM 36.2385
836 4XUC 43G 36.2385
837 4YMH SAH 37.1308
838 5N5D SAM 37.1681
839 5ZW3 SAH 38.3966
840 3DUW SAH 39.9103
Pocket No.: 2; Query (leader) PDB : 3C3Y; Ligand: SAH; Similar sites found with APoc: 40
This union binding pocket(no: 2) in the query (biounit: 3c3y.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
1 4HA6 FAD 1.26582
2 3NJ4 AFX 2.1097
3 4DD8 BAT 2.40385
4 3RNM FAD 2.53165
5 1COY AND 2.53165
6 4D52 GXL 2.53165
7 5TSH ANP 2.53165
8 3LCC SAH 2.55319
9 4ZCC NAI 2.95359
10 4ZCC FAD 2.95359
11 3ITJ CIT 3.37553
12 6AC9 ANP 3.37553
13 1OC2 TDX 3.79747
14 1C0I FAD 4.21941
15 1C0I BE2 4.21941
16 1NAA 6FA 4.64135
17 1I2B UPG 4.64135
18 1I2B NAD 4.64135
19 1I2B USQ 4.64135
20 4EMI FAD 5.06329
21 5A3B APR 5.90717
22 1L1Q 9DA 6.45161
23 5FJN FAD 6.75105
24 2B4R AES 7.173
25 5EZ7 FAD 7.59494
26 2V2G BEZ 7.72532
27 3NTD FAD 8.01688
28 3NT6 FAD 8.01688
29 2FK8 SAM 8.01688
30 2HYQ MAN MAN 8.19672
31 2GUC MAN 8.19672
32 3VZS CAA 8.56031
33 3QFA FAD 8.86076
34 1H9A NAP 9.70464
35 2FZW NAD 12.6582
36 2C3H GLC GLC 13.2653
37 5FFF NAP 16.0338
38 2A8X FAD 16.8776
39 2GMH FAD 16.8776
40 4M52 M52 17.2996
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