Receptor
PDB id Resolution Class Description Source Keywords
3C6K 1.95 Å EC: 2.5.1.22 CRYSTAL STRUCTURE OF HUMAN SPERMINE SYNTHASE IN COMPLEX WITH SPERMIDINE AND 5-METHYLTHIOADENOSINE HOMO SAPIENS SPERMIDINE AMINOPROPYLTRANSFERASE SPMSY STRUCTURAL GENOMICS STRUCTURAL GENOMICS CONSORTIUM SGC PHOSPHOPROTEIN
Ref.: CRYSTAL STRUCTURE OF HUMAN SPERMINE SYNTHASE: IMPLICATIONS OF SUBSTRATE BINDING AND CATALYTIC MECHANISM. J.BIOL.CHEM. V. 283 16135 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MTA A:401;
B:401;
C:401;
D:401;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
Ki = 0.3 uM
297.334 C11 H15 N5 O3 S CSC[C...
SPD A:501;
B:501;
C:501;
D:501;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
145.246 C7 H19 N3 C(CCN...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3C6K 1.95 Å EC: 2.5.1.22 CRYSTAL STRUCTURE OF HUMAN SPERMINE SYNTHASE IN COMPLEX WITH SPERMIDINE AND 5-METHYLTHIOADENOSINE HOMO SAPIENS SPERMIDINE AMINOPROPYLTRANSFERASE SPMSY STRUCTURAL GENOMICS STRUCTURAL GENOMICS CONSORTIUM SGC PHOSPHOPROTEIN
Ref.: CRYSTAL STRUCTURE OF HUMAN SPERMINE SYNTHASE: IMPLICATIONS OF SUBSTRATE BINDING AND CATALYTIC MECHANISM. J.BIOL.CHEM. V. 283 16135 2008
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3C6M Ki = 0.3 uM MTA C11 H15 N5 O3 S CSC[C@@H]1....
2 3C6K Ki = 0.3 uM MTA C11 H15 N5 O3 S CSC[C@@H]1....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3C6M Ki = 0.3 uM MTA C11 H15 N5 O3 S CSC[C@@H]1....
2 3C6K Ki = 0.3 uM MTA C11 H15 N5 O3 S CSC[C@@H]1....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3C6M Ki = 0.3 uM MTA C11 H15 N5 O3 S CSC[C@@H]1....
2 3C6K Ki = 0.3 uM MTA C11 H15 N5 O3 S CSC[C@@H]1....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: MTA; Similar ligands found: 256
No: Ligand ECFP6 Tc MDL keys Tc
1 MTA 1 1
2 DTA 0.786885 0.867647
3 3DH 0.777778 0.938462
4 RAB 0.758621 0.878788
5 XYA 0.758621 0.878788
6 ADN 0.758621 0.878788
7 DSH 0.705882 0.84507
8 5N5 0.704918 0.878788
9 A4D 0.693548 0.907692
10 5CD 0.693548 0.892308
11 EP4 0.6875 0.939394
12 M2T 0.676923 0.940298
13 A7D 0.657534 0.882353
14 5X8 0.64 0.895522
15 5AD 0.639344 0.857143
16 ZAS 0.628571 0.816901
17 AMP 0.628571 0.794521
18 A 0.628571 0.794521
19 A5D 0.623377 0.867647
20 SAH 0.615385 0.869565
21 ABM 0.60274 0.821918
22 J7C 0.60274 0.794521
23 AAT 0.6 0.797297
24 6RE 0.597222 0.783784
25 SRA 0.597222 0.776316
26 S4M 0.594595 0.84
27 AOC 0.589041 0.880597
28 AMP MG 0.589041 0.773333
29 MAO 0.586667 0.805195
30 S8M 0.583333 0.833333
31 A2D 0.581081 0.773333
32 A3N 0.581081 0.867647
33 5AS 0.578947 0.697674
34 GJV 0.573333 0.773333
35 BA3 0.565789 0.773333
36 A12 0.565789 0.74359
37 AP2 0.565789 0.74359
38 M33 0.564103 0.810811
39 AU1 0.564103 0.753247
40 MHZ 0.564103 0.805195
41 ADX 0.564103 0.719512
42 ADP 0.558442 0.773333
43 AP5 0.558442 0.773333
44 B4P 0.558442 0.773333
45 7D7 0.553846 0.794118
46 Y3J 0.552239 0.80303
47 AN2 0.551282 0.763158
48 SON 0.551282 0.74359
49 SXZ 0.550562 0.849315
50 PRX 0.55 0.8
51 A6D 0.545455 0.766234
52 CA0 0.544304 0.753247
53 ADP MG 0.544304 0.763158
54 SA8 0.54321 0.873239
55 AD9 0.54321 0.753247
56 EEM 0.542169 0.849315
57 BEF ADP 0.5375 0.74359
58 50T 0.5375 0.763158
59 SFG 0.5375 0.826087
60 ACP 0.5375 0.753247
61 ATP 0.5375 0.773333
62 ADP BEF 0.5375 0.74359
63 AR6 0.530864 0.773333
64 APR 0.530864 0.773333
65 5FA 0.530864 0.773333
66 APC 0.530864 0.74359
67 AQP 0.530864 0.773333
68 ANP 0.53012 0.753247
69 SAM 0.53012 0.875
70 SMM 0.529412 0.84
71 3AM 0.527027 0.756757
72 NEC 0.526316 0.823529
73 RBY 0.52439 0.74359
74 SAP 0.52439 0.75641
75 AGS 0.52439 0.75641
76 ADP PO3 0.52439 0.794521
77 ADV 0.52439 0.74359
78 5AL 0.52381 0.786667
79 VMS 0.523256 0.705882
80 54H 0.523256 0.705882
81 3AD 0.521739 0.863636
82 MTH 0.520548 0.984127
83 SAI 0.518072 0.830986
84 G5A 0.518072 0.678161
85 ATP MG 0.518072 0.763158
86 A5A 0.517647 0.722892
87 ME8 0.516484 0.797468
88 ACQ 0.511905 0.753247
89 GAP 0.511905 0.753247
90 TAT 0.511905 0.766234
91 S7M 0.511628 0.824324
92 8QN 0.511364 0.786667
93 CC5 0.507463 0.876923
94 A3G 0.506494 0.828571
95 A3P 0.506329 0.77027
96 52H 0.505747 0.697674
97 MTP 0.5 0.828571
98 ADP ALF 0.5 0.734177
99 MAP 0.5 0.734177
100 TSB 0.5 0.714286
101 7D5 0.5 0.714286
102 ATF 0.5 0.74359
103 ALF ADP 0.5 0.734177
104 53H 0.5 0.697674
105 DAL AMP 0.5 0.786667
106 5SV 0.494382 0.759494
107 25A 0.494382 0.773333
108 SSA 0.494253 0.678161
109 ANP MG 0.494253 0.734177
110 ADP VO4 0.494253 0.763158
111 SRP 0.494253 0.74359
112 VO4 ADP 0.494253 0.763158
113 2AM 0.493333 0.746667
114 26A 0.492958 0.867647
115 0UM 0.488889 0.810811
116 ADQ 0.488889 0.753247
117 LSS 0.488889 0.701149
118 DSZ 0.488889 0.678161
119 PAJ 0.488889 0.75
120 A1R 0.488889 0.725
121 3OD 0.483871 0.776316
122 62X 0.483516 0.815789
123 NVA LMS 0.483516 0.701149
124 AHX 0.483516 0.716049
125 A22 0.483146 0.763158
126 5CA 0.483146 0.678161
127 A3T 0.481928 0.880597
128 2VA 0.481928 0.855072
129 RP1 0.480519 0.75
130 SP1 0.480519 0.75
131 3L1 0.478873 0.8
132 3D1 0.478873 0.8
133 OAD 0.478261 0.776316
134 K15 0.478261 0.813333
135 LEU LMS 0.478261 0.701149
136 GEK 0.477778 0.833333
137 OOB 0.477778 0.763158
138 A3S 0.47561 0.84058
139 OVE 0.474359 0.74026
140 PR8 0.473118 0.698795
141 P5A 0.473118 0.648352
142 AMO 0.472527 0.74359
143 NSS 0.472527 0.678161
144 4AD 0.472527 0.734177
145 6MD 0.472222 0.893939
146 2FA 0.472222 0.816901
147 NOC 0.471429 0.791045
148 A2P 0.469136 0.756757
149 2BA 0.469136 0.767123
150 CMP 0.469136 0.777778
151 TXA 0.468085 0.766234
152 PTJ 0.468085 0.759494
153 1ZZ 0.468085 0.731707
154 QQX 0.467532 0.714286
155 00A 0.467391 0.725
156 DLL 0.467391 0.763158
157 5F1 0.465753 0.782609
158 MYR AMP 0.463158 0.731707
159 3UK 0.462366 0.753247
160 ADP BMA 0.462366 0.753247
161 ACK 0.461538 0.739726
162 QQY 0.461538 0.723684
163 GSU 0.457447 0.678161
164 A A 0.457447 0.773333
165 WAQ 0.457447 0.725
166 LAD 0.457447 0.707317
167 KAA 0.457447 0.655556
168 PPS 0.454545 0.698795
169 PAP 0.453488 0.76
170 NVA 2AD 0.453488 0.816901
171 NB8 0.452632 0.716049
172 JB6 0.452632 0.746835
173 FYA 0.452632 0.763158
174 BIS 0.452632 0.725
175 1DA 0.452055 0.878788
176 XAH 0.44898 0.690476
177 TYR AMP 0.44898 0.74359
178 VRT 0.448276 0.84507
179 SO8 0.448276 0.869565
180 25L 0.447917 0.763158
181 KB1 0.447917 0.786667
182 4UV 0.444444 0.734177
183 9SN 0.443299 0.716049
184 V3L 0.443182 0.773333
185 LAQ 0.441176 0.710843
186 7D3 0.439024 0.696203
187 ATP A A A 0.438776 0.783784
188 FA5 0.438776 0.74359
189 YAP 0.438776 0.734177
190 J1A 0.4375 0.740741
191 LPA AMP 0.436893 0.710843
192 J1C 0.435897 0.67033
193 AFH 0.435644 0.707317
194 7MD 0.435644 0.690476
195 4UU 0.435644 0.734177
196 J1B 0.434783 0.67033
197 YSA 0.434343 0.678161
198 TXD 0.432692 0.746835
199 4UW 0.432692 0.75
200 ARJ 0.432432 0.776119
201 MCF 0.432099 0.842857
202 KH3 0.431373 0.802632
203 TAD 0.431373 0.728395
204 GTA 0.431373 0.731707
205 4YB 0.431373 0.662921
206 AMP DBH 0.43 0.753247
207 IVH 0.428571 0.813333
208 AHZ 0.427184 0.731707
209 ARG AMP 0.427184 0.682353
210 3NZ 0.427083 0.833333
211 7C5 0.425743 0.773333
212 G3A 0.425743 0.716049
213 2A5 0.425287 0.708861
214 7MC 0.424528 0.694118
215 AP0 0.424528 0.7375
216 TT8 0.423913 0.898551
217 YLP 0.423077 0.694118
218 48N 0.423077 0.7375
219 CNA 0.422018 0.74359
220 AR6 AR6 0.421569 0.773333
221 G5P 0.421569 0.716049
222 ATR 0.420455 0.746667
223 101 0.419753 0.714286
224 D3Y 0.419355 0.816901
225 NXX 0.419048 0.74359
226 NAX 0.419048 0.698795
227 DND 0.419048 0.74359
228 6V0 0.419048 0.716049
229 NAI 0.419048 0.725
230 7D4 0.418605 0.696203
231 A A A 0.416667 0.763158
232 OMR 0.415094 0.722892
233 TXE 0.415094 0.725
234 649 0.415094 0.648352
235 D5M 0.414634 0.714286
236 DA 0.414634 0.714286
237 T5A 0.412844 0.694118
238 139 0.412844 0.698795
239 ADJ 0.412844 0.702381
240 YLB 0.411215 0.714286
241 YLC 0.411215 0.710843
242 J1D 0.410714 0.628866
243 AYB 0.409091 0.705882
244 A2R 0.408602 0.763158
245 A4P 0.407407 0.659091
246 UP5 0.40566 0.734177
247 NAD IBO 0.405405 0.75641
248 IOT 0.40367 0.666667
249 6CR 0.402597 0.805556
250 WSA 0.401869 0.686047
251 TYM 0.401869 0.74359
252 LA8 ALF 3PG 0.401869 0.707317
253 ALF ADP 3PG 0.401869 0.707317
254 AF3 ADP 3PG 0.401869 0.707317
255 4TA 0.401786 0.702381
256 YLA 0.4 0.674419
Ligand no: 2; Ligand: SPD; Similar ligands found: 8
No: Ligand ECFP6 Tc MDL keys Tc
1 SPD 1 1
2 37Z 0.85 0.913043
3 SPM 0.809524 1
4 NSD 0.75 0.913043
5 SS9 0.607143 0.958333
6 Q9C 0.545455 0.71875
7 SP5 0.514286 0.71875
8 FKS 0.5 0.638889
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3C6K; Ligand: MTA; Similar sites found: 310
This union binding pocket(no: 1) in the query (biounit: 3c6k.bio1) has 37 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2V3A FAD 0.0005682 0.41403 1.31234
2 3LXD FAD 0.00207 0.40373 1.31234
3 3M6W SAM 0.005109 0.43653 1.50862
4 1F3L SAH 0.0002709 0.47506 1.55763
5 3DMH SAM 0.0001076 0.49704 1.5748
6 3DMH GMP 0.0002472 0.4581 1.5748
7 3GD4 FAD 0.001455 0.40334 1.5748
8 3KYG 5GP 5GP 0.02448 0.40359 1.76211
9 1A8U BEZ 0.01498 0.4329 1.80505
10 1A8S PPI 0.03406 0.40773 1.8315
11 4KRI SAH 0.000172 0.48799 1.83727
12 1DJN ADP 0.008894 0.40607 1.83727
13 1YXM ADE 0.01942 0.42421 1.9802
14 3O7W SAM 0.006002 0.43705 2.04082
15 2CDU ADP 0.002385 0.44839 2.09974
16 3L9W GSH 0.0004522 0.44445 2.09974
17 3L9W AMP 0.0007276 0.43054 2.09974
18 5CX6 CDP 0.0266 0.42174 2.09974
19 2CDU FAD 0.0008905 0.41443 2.09974
20 3ABI NAD 0.002481 0.41279 2.09974
21 1NV8 MEQ 0.001498 0.42684 2.11268
22 1NV8 SAM 0.00181 0.42078 2.11268
23 3TLJ SAH 0.001553 0.43858 2.14477
24 4OBW SAM 0.000393 0.48068 2.33463
25 5JJR SAH 0.000366 0.48211 2.3622
26 4UCI SAM 0.00057 0.46895 2.3622
27 4AZW SAM 0.00775 0.41757 2.3622
28 1NSA BEN 0.008967 0.41626 2.3622
29 1ZBQ NAD 0.0025 0.40771 2.3622
30 1YQT ADP 0.04932 0.40497 2.3622
31 5VN0 NAI 0.007094 0.4023 2.3622
32 1X14 NAD 0.02455 0.40045 2.3622
33 5VN0 FAD 0.001422 0.40024 2.3622
34 1L1E SAH 0.008239 0.41328 2.43902
35 3GDH SAH 0.0001954 0.47318 2.48963
36 2OG2 MLI 0.03491 0.41054 2.50696
37 1NW5 SAM 0.0001156 0.50033 2.50784
38 3A27 SAM 0.0004385 0.47848 2.57353
39 5N2I NAP 0.004787 0.42379 2.58621
40 3VYW SAM 0.00008929 0.50064 2.5974
41 2PX8 SAH 0.0005907 0.47251 2.60223
42 2WPF WPF 0.008185 0.41574 2.62467
43 2WPF FAD 0.008048 0.41469 2.62467
44 2ZXI FAD 0.001728 0.40125 2.62467
45 1UWK URO 0.0000491 0.42379 2.693
46 1UWK NAD 0.0000491 0.42379 2.693
47 2VT3 ATP 0.002182 0.46329 2.7907
48 3IHG FAD 0.001273 0.42678 2.80374
49 3GUZ PAF 0.03091 0.40919 2.84091
50 2DT5 NAD 0.003097 0.41161 2.8436
51 4N49 SAM 0.0003077 0.47677 2.88714
52 2BRY FAD 0.0009654 0.42058 2.88714
53 4TXI FAD 0.002583 0.40717 2.88714
54 2EG5 SAH 0.00346 0.44883 2.95699
55 2ZQO NGA 0.0429 0.4148 3.07692
56 4TQG NDP 0.004516 0.40516 3.09598
57 3DUW SAH 0.0004489 0.47365 3.13901
58 1YS4 NAP 0.008272 0.41026 3.14961
59 3HVJ 705 0.0009937 0.40902 3.16742
60 1USI PHE 0.035 0.41353 3.17919
61 3GCZ SAM 0.0001983 0.4944 3.19149
62 1OFZ FUC 0.02291 0.4257 3.20513
63 3NUG NAD 0.001528 0.41828 3.23887
64 3OFK SAH 0.001132 0.44797 3.24074
65 5AHO TLA 0.01711 0.42328 3.27381
66 1IM8 SAI 0.00005774 0.50905 3.27869
67 1EJ0 SAM 0.0001138 0.50554 3.33333
68 2ZIF SAM 0.0003254 0.47998 3.367
69 5X62 SAH 0.0006886 0.47383 3.41207
70 3CGB FAD 0.001281 0.40536 3.41207
71 2A14 SAH 0.006709 0.41423 3.42205
72 3H2B SAH 0.004526 0.42817 3.44828
73 5MUA GAL 0.02531 0.41702 3.4965
74 4LWP SAH 0.0000415 0.52577 3.53261
75 2DT9 THR 0.01382 0.431 3.59281
76 2WPB ZZI 0.01531 0.43306 3.61842
77 3A25 SAM 0.0006708 0.46996 3.65448
78 1JG3 ADN 0.00007306 0.51442 3.67454
79 5THY SAH 0.008938 0.4117 3.67454
80 2EJU SAH 0.0006525 0.47051 3.7037
81 3T7S SAM 0.003817 0.43506 3.73134
82 2HNK SAH 0.0004689 0.46864 3.76569
83 1ZEM NAD 0.003816 0.41327 3.81679
84 4CNK FAD 0.001641 0.40738 3.83632
85 1Q0S SAH 0.000425 0.45899 3.861
86 3VYK MMA MAN NAG MAN NAG NAG 0.02831 0.41847 3.87597
87 1I9G SAM 0.000164 0.48891 3.93701
88 1P77 ATR 0.004421 0.46232 3.93701
89 1ZMD NAI 0.003493 0.41761 3.93701
90 4D79 ATP 0.002364 0.44467 3.98551
91 5CQG 55C 0.03165 0.41125 4.02685
92 2WET FAD 0.0003695 0.40968 4.10959
93 2WE0 UMP 0.03445 0.40617 4.1958
94 3VSE SAH 0.00001458 0.57264 4.19948
95 3KLJ FAD 0.0007588 0.42443 4.19948
96 4MIG G3F 0.002401 0.41126 4.19948
97 1VQW FAD 0.002628 0.40454 4.19948
98 3UDZ ADP 0.01844 0.40332 4.19948
99 2GVC FAD 0.003132 0.40173 4.19948
100 4R6W SAH 0.0002649 0.44421 4.26357
101 2BQP GLC 0.02315 0.4176 4.2735
102 5DXA SFG 0.00018 0.47865 4.29799
103 5DX1 SFG 0.0001519 0.47389 4.29799
104 5DX8 SFG 0.0002512 0.47246 4.29799
105 5DWQ SFG 0.0002346 0.46984 4.29799
106 5DX0 SFG 0.0001936 0.46954 4.29799
107 5HTX ADP 0.04365 0.40077 4.32802
108 2VSU ACO 0.02111 0.40357 4.36364
109 4IWN GEK 0.0006328 0.45528 4.36681
110 3A4T SFG 0.0001484 0.48646 4.37956
111 4QTU SAM 0.0001218 0.4993 4.44444
112 1JZN BGC GAL 0.01848 0.44879 4.44444
113 5K7U SAM 0.003313 0.4379 4.44444
114 1X87 NAD 0.00003517 0.50901 4.46194
115 2UYQ SAM 0.0131 0.43664 4.46194
116 1OFL NGK GCD 0.03978 0.41333 4.46194
117 1WDK NAD 0.007603 0.409 4.46194
118 5EB4 FAD 0.002359 0.40392 4.46194
119 1N2X SAM 0.003892 0.42149 4.65116
120 1VBO MAN MAN MAN 0.03808 0.41044 4.69799
121 1VBO MAN 0.03573 0.4095 4.69799
122 5IL1 SAM 0.00181 0.45004 4.71698
123 4EUE NAI 0.0005161 0.43337 4.72441
124 5SYN 71T 0.00853 0.42225 4.72441
125 1KPG SAH 0.01085 0.40509 4.87805
126 1TPY SAH 0.0109 0.40501 4.87805
127 3OJO NAD 0.003066 0.42592 4.98688
128 3S5W FAD 0.001472 0.4189 4.98688
129 2XVF FAD 0.001045 0.40826 4.98688
130 4TM3 FAD 0.00753 0.40482 4.98688
131 3FZG SAM 0.00641 0.43178 5
132 1GZ6 NAI 0.002791 0.40832 5.01567
133 3BXO SAM 0.002717 0.454 5.02092
134 3EHH ADP 0.0406 0.40603 5.04587
135 4AVB CMP 0.0258 0.40911 5.1051
136 4Y2H SAH 0.0009994 0.41617 5.11364
137 4Y2H 49K 0.001376 0.41122 5.11364
138 3FUU ADN 0.0001394 0.49664 5.16605
139 1XHC FAD 0.0007601 0.41685 5.17711
140 1Y8Q ATP 0.0001427 0.47892 5.24934
141 2VDV SAM 0.0004744 0.49128 5.28455
142 1R18 SAH 0.0004822 0.46414 5.28634
143 1I1N SAH 0.0006461 0.44143 5.30973
144 1JNR FAD 0.005007 0.41467 5.33333
145 3MMH SME 0.03691 0.4046 5.38922
146 1V59 NAD 0.00008872 0.53322 5.51181
147 4DMG SAM 0.0002894 0.50741 5.51181
148 1OBB NAD 0.002478 0.42677 5.51181
149 5M58 SAH 0.006636 0.42063 5.51181
150 1U1I NAD 0.001276 0.41365 5.51181
151 5F8F SFG 0.001997 0.45619 5.57029
152 3K0T BGC 0.04033 0.40665 5.59441
153 5ULP KB1 0.0002209 0.47094 5.59701
154 5BW4 SAM 0.0006829 0.474 5.61798
155 5DLY SAH 0.001512 0.40296 5.6391
156 5N53 8NB 0.04488 0.4077 5.64103
157 5HJM MTA 0.0002789 0.48301 5.68182
158 1O94 ADP 0.01045 0.40043 5.68182
159 2PEH LYS ARG LYS SER ARG TRP ASP GLU THR PRO 0.04294 0.40115 5.71429
160 2HYR BGC GLC 0.01771 0.41848 5.7377
161 2NUO BGC 0.03495 0.40187 5.7377
162 2GUD BMA 0.04885 0.40072 5.7377
163 2GUC MAN 0.04168 0.40051 5.7377
164 1E3W NAD 0.00409 0.40439 5.74713
165 4C4A SAH 0.00002592 0.52973 5.77428
166 2PXX SAH 0.001421 0.45098 5.77428
167 5MPT SAH 0.001782 0.45035 5.77428
168 2NXE SAM 0.005641 0.4272 5.77428
169 4EJN 0R4 0.01651 0.40555 5.77428
170 2AOT SAH 0.001616 0.46062 5.82192
171 2XYQ SAH 0.0001212 0.50427 5.86207
172 1XDS SAM 0.002459 0.45614 5.88235
173 3Q87 SAM 0.006116 0.41306 5.88235
174 1KPH SAH 0.01176 0.40357 5.92335
175 5F7J ADE 0.02076 0.42758 5.9375
176 3GXO SAH 0.01302 0.42044 5.96206
177 3GWZ SAH 0.01626 0.41566 5.96206
178 2FK8 SAM 0.008109 0.41359 5.97484
179 2BZG SAH 0.0006866 0.46949 6.03448
180 4KRG SAH 0.000925 0.46779 6.03675
181 4FK7 P34 0.03058 0.41755 6.11354
182 5KVA SAM 0.001159 0.44753 6.11511
183 3P2E SAH 0.009106 0.41134 6.22222
184 1L3I SAH 0.0001274 0.47705 6.25
185 4PNE SAH 0.009402 0.40504 6.29139
186 3PT9 SAH 0.0001301 0.50285 6.29921
187 3G89 SAM 0.001448 0.46746 6.29921
188 4AZT SAM 0.004595 0.43133 6.29921
189 3EGI ADP 0.00002387 0.58487 6.31068
190 5IDB BMA 0.01493 0.42903 6.33803
191 5IDB MAN 0.01493 0.42903 6.33803
192 2YVJ NAI 0.004213 0.43307 6.42202
193 5LOG SAH 0.000289 0.48231 6.43777
194 3GRU AMP 0.0003346 0.46713 6.44068
195 3H8V ATP 0.0007147 0.46868 6.50685
196 3UCL NAP 0.003412 0.41811 6.56168
197 3UCL FAD 0.003318 0.41663 6.56168
198 3UCL CYH 0.003318 0.41663 6.56168
199 3GU3 SAH 0.00118 0.48191 6.69014
200 5XVQ SAH 0.00151 0.43911 6.69014
201 5XVK SAH 0.002034 0.43356 6.69014
202 3VC1 SAH 0.01015 0.40636 6.73077
203 3ICT ADP 0.001473 0.47187 6.82415
204 3ICS ADP 0.001798 0.46751 6.82415
205 1P31 EPU 0.005048 0.42944 6.82415
206 4USR FAD 0.001708 0.41144 6.82415
207 3ICT FAD 0.001236 0.40526 6.82415
208 3ICR FAD 0.001301 0.40503 6.82415
209 1MUU NAD 0.008577 0.40145 6.82415
210 5FA8 SAM 0.0005765 0.45702 6.8323
211 1KYZ SAH 0.01186 0.41548 6.84932
212 4XUC SAM 0.0002368 0.44021 6.88073
213 4XUC 43G 0.0002368 0.44021 6.88073
214 1G60 SAM 0.001301 0.45271 6.92308
215 4RDH AMP 0.0008321 0.47449 6.94444
216 4RDI ATP 0.001262 0.45728 6.94444
217 4RL4 PPV 0.02278 0.40439 7.07547
218 1DL5 SAH 0.000147 0.47073 7.08661
219 1WY7 SAH 0.0005464 0.46177 7.08661
220 2H7C SIA 0.04622 0.40844 7.08661
221 1RJD SAM 0.01239 0.40536 7.08661
222 4FZV SAM 0.0002977 0.47741 7.11297
223 1LSS NAD 0.000156 0.48988 7.14286
224 4X60 SFG 0.0005309 0.41135 7.14286
225 4X60 3XV 0.0005251 0.40815 7.14286
226 3X0D SAH 0.0000455 0.51866 7.17557
227 4NEC SAH 0.0009989 0.47068 7.19697
228 1NU4 MLA 0.03352 0.41895 7.2165
229 1VAY AZA 0.0442 0.4089 7.31707
230 5HS2 CTP 0.02028 0.40757 7.32759
231 1ZQ9 SAM 0.00006065 0.51816 7.34908
232 1N4W FAD 0.0003283 0.40543 7.53968
233 2P41 SAH 0.0001959 0.49465 7.54098
234 1G55 SAH 0.001106 0.45592 7.61155
235 2RGO FAD 0.00148 0.40305 7.61155
236 3VY6 BGC BGC 0.02234 0.41672 7.80142
237 5ITV NAI 0.00273 0.40869 7.84314
238 3DXY SAM 0.0002966 0.50687 7.87402
239 2JJQ SAH 0.0002464 0.50527 7.87402
240 2GAG NAD 0.001468 0.40328 7.87402
241 1VE3 SAM 0.008059 0.42003 7.92952
242 3EVG SAH 0.000252 0.48959 8
243 4POO SAM 0.001295 0.43864 8
244 5JGL SAM 0.01082 0.41736 8.13648
245 2YX1 SFG 0.00007641 0.53027 8.33333
246 1CM0 COA 0.02575 0.40574 8.33333
247 1OFS SUC 0.04549 0.40416 8.33333
248 3S1S SAH 0.001047 0.44593 8.39895
249 5WGR FAD 0.0004739 0.40952 8.39895
250 2DPM SAM 0.001617 0.44122 8.4507
251 2XVM SAH 0.00475 0.44205 8.54271
252 5MGZ SAH 0.003596 0.4327 8.66142
253 3BGD SAH 0.000835 0.45013 8.84615
254 3BGD PM6 0.001581 0.42591 8.84615
255 5D4V SAH 0.01167 0.4037 8.95522
256 4YMH SAH 0.0005026 0.4673 9.16667
257 5E9W SAH 0.0003587 0.50272 9.18635
258 5E8J SAH 0.00056 0.48774 9.18635
259 4ONQ SFG 0.003016 0.43979 9.18635
260 4Y4V DAL 0.03054 0.40312 9.43953
261 1Z3C SA8 0.001541 0.42079 9.44882
262 4II2 ATP 0.001132 0.45163 9.63855
263 3LKZ SFG 0.0001579 0.4942 9.65732
264 2HXW FLC 0.0439 0.408 9.70464
265 1XTP SAI 0.006277 0.42506 9.84252
266 5L95 AMP 0.0002137 0.48825 9.97375
267 1SQF SAM 0.0006435 0.47079 9.97375
268 2D2I NAP 0.008443 0.40705 9.97375
269 3EGV SAH 0.006253 0.42862 10.2041
270 3LCC SAH 0.001033 0.46553 10.2128
271 5E1M SAH 0.00146 0.41153 10.2362
272 5E1M PRO PRO LYS ARG ILE ALA 0.00146 0.41153 10.2362
273 5DYO FLU 0.03735 0.40967 10.2362
274 4DCM SAM 0.0009494 0.47174 10.4
275 4RYV ZEA 0.03216 0.40773 10.4987
276 1DCP HBI 0.03567 0.40139 10.5769
277 1GXS DKA 0.04062 0.41057 10.7595
278 3I53 SAH 0.01036 0.40884 10.8434
279 4M73 M72 0.001546 0.40253 10.9792
280 3WV8 ATP 0.0003283 0.4798 11.0092
281 3OU2 SAH 0.002023 0.42742 11.4679
282 3C3Y SAH 0.001227 0.45386 11.8143
283 1KYQ NAD 0.0005471 0.47854 12.336
284 5JE0 SAH 0.001585 0.41768 12.336
285 5JE0 AZ8 0.001585 0.41768 12.336
286 2HK9 ATR 0.01529 0.42453 13.0909
287 3AD8 NAD 0.001833 0.40794 15.2709
288 1XCL SAH 0.0003564 0.43939 16.0105
289 1P1C SAH 0.0002524 0.47237 16.0804
290 4KXQ APR 0.01163 0.40378 16.726
291 5KOK SAH 0.003648 0.43242 17.8478
292 1FAO 4IP 0.03629 0.41255 18.254
293 2V3B FAD 0.0005996 0.41682 20
294 1QAN SAH 0.0001305 0.48889 20.4918
295 4FE2 AIR 0.03851 0.40363 20.7349
296 2PT9 S4M 0.00000000003868 0.74632 21.1838
297 2PT9 2MH 0.00000000002195 0.69546 21.1838
298 1QZZ SAM 0.01353 0.41961 21.2598
299 3AB4 THR 0.01938 0.42319 21.3483
300 2DTJ THR 0.02571 0.41281 21.9101
301 1LES GLC FRU 0.01483 0.423 23.0769
302 2I7C AAT 0.00000000009359 0.6726 24.0283
303 1JQ3 AAT 0.0000000001683 0.66967 29.0541
304 3G2O SAM 0.004765 0.4306 29.097
305 2F5Z FAD 0.001587 0.41317 29.6875
306 2O07 MTA 0.0000000001111 0.71156 30.5921
307 2O07 SPD 0.000000000144 0.69243 30.5921
308 4YUW 4JU 0.000000004023 0.40134 36.1842
309 4M38 SAH 0.0001111 0.49643 42.8571
310 5FA5 MTA 0.00002302 0.54946 45
Pocket No.: 2; Query (leader) PDB : 3C6K; Ligand: MTA; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 3c6k.bio1) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3C6K; Ligand: SPD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 3c6k.bio1) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3C6K; Ligand: SPD; Similar sites found: 332
This union binding pocket(no: 4) in the query (biounit: 3c6k.bio1) has 37 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2V3A FAD 0.0005682 0.42375 1.31234
2 3M6W SAM 0.005109 0.43653 1.50862
3 1F3L SAH 0.0002709 0.47506 1.55763
4 3DMH SAM 0.0001076 0.49704 1.5748
5 3DMH GMP 0.0002472 0.4581 1.5748
6 4K5S FAD 0.002412 0.40591 1.5748
7 3GD4 FAD 0.001455 0.40334 1.5748
8 3KYG 5GP 5GP 0.02448 0.40359 1.76211
9 1A8U BEZ 0.01498 0.4329 1.80505
10 1A8S PPI 0.03406 0.40773 1.8315
11 4KRI SAH 0.000172 0.48799 1.83727
12 1LVL NAD 0.0002501 0.48077 1.83727
13 2Q28 ADP 0.001045 0.45703 1.83727
14 1DJN ADP 0.008894 0.40607 1.83727
15 2BH9 NAP 0.02219 0.40567 1.83727
16 1VKO NAD 0.003984 0.40012 1.8622
17 1YXM ADE 0.01942 0.42421 1.9802
18 2CDU ADP 0.002385 0.44839 2.09974
19 3L9W GSH 0.0004522 0.44445 2.09974
20 3L9W AMP 0.0007276 0.43054 2.09974
21 5CX6 CDP 0.0266 0.42174 2.09974
22 2CDU FAD 0.0008905 0.41443 2.09974
23 3ABI NAD 0.002481 0.41279 2.09974
24 3TLJ SAH 0.001553 0.43858 2.14477
25 4OBW SAM 0.000393 0.48068 2.33463
26 5JJR SAH 0.000366 0.48211 2.3622
27 4UCI SAM 0.00057 0.46895 2.3622
28 4AZW SAM 0.00775 0.41757 2.3622
29 1NSA BEN 0.008967 0.41626 2.3622
30 1ZBQ NAD 0.0025 0.40771 2.3622
31 1YQT ADP 0.04932 0.40497 2.3622
32 5VN0 NAI 0.007094 0.4023 2.3622
33 1X14 NAD 0.02455 0.40045 2.3622
34 5VN0 FAD 0.001422 0.40024 2.3622
35 1L1E SAH 0.008239 0.41328 2.43902
36 3GDH SAH 0.0001954 0.47318 2.48963
37 2OG2 MLI 0.03491 0.41054 2.50696
38 1NW5 SAM 0.0001156 0.50033 2.50784
39 4A6D SAM 0.003329 0.43422 2.54958
40 3A27 SAM 0.0004385 0.47848 2.57353
41 5N2I NAP 0.004787 0.42379 2.58621
42 3VYW SAM 0.00008929 0.50064 2.5974
43 2PX8 SAH 0.0005907 0.47251 2.60223
44 1MO9 FAD 0.0009964 0.44449 2.62467
45 1MO9 KPC 0.001615 0.43683 2.62467
46 2WPF WPF 0.008185 0.41574 2.62467
47 2WPF FAD 0.008048 0.41469 2.62467
48 2ZXI FAD 0.001728 0.40125 2.62467
49 1FP1 SAH 0.006539 0.43136 2.68817
50 1UWK NAD 0.0000491 0.42379 2.693
51 1UWK URO 0.0000491 0.42379 2.693
52 3B1F NAD 0.01059 0.40556 2.75862
53 3IHG FAD 0.001273 0.42678 2.80374
54 3GUZ PAF 0.03091 0.40919 2.84091
55 2DT5 NAD 0.003097 0.41161 2.8436
56 4N49 SAM 0.0003077 0.47677 2.88714
57 2YVF NAD 0.002571 0.4188 2.88714
58 2YVF FAD 0.002461 0.4188 2.88714
59 4TXI FAD 0.002583 0.40717 2.88714
60 2BRY FAD 0.0009654 0.40525 2.88714
61 2EG5 SAH 0.00346 0.44883 2.95699
62 2ZQO NGA 0.0429 0.4148 3.07692
63 4TQG NDP 0.004516 0.40516 3.09598
64 3DUW SAH 0.0004489 0.47365 3.13901
65 1YS4 NAP 0.008272 0.41026 3.14961
66 3LZW FAD 0.001374 0.40075 3.14961
67 3HVJ 705 0.0009937 0.41395 3.16742
68 1OFZ FUC 0.02291 0.4257 3.20513
69 3OFK SAH 0.001132 0.44797 3.24074
70 5AHO TLA 0.01711 0.42328 3.27381
71 1IM8 SAI 0.00005774 0.50905 3.27869
72 1EJ0 SAM 0.0001138 0.50554 3.33333
73 2ZIF SAM 0.0003254 0.47998 3.367
74 5X62 SAH 0.0006886 0.47383 3.41207
75 2IZ1 ATR 0.01344 0.43302 3.41207
76 1VBH PEP 0.03913 0.4114 3.41207
77 3CGB FAD 0.001281 0.40536 3.41207
78 2A14 SAH 0.006709 0.41423 3.42205
79 3H2B SAH 0.004526 0.42817 3.44828
80 1A5Z NAD 0.007891 0.41115 3.44828
81 3TKA SAM 0.001462 0.4467 3.45821
82 5MUA GAL 0.02531 0.41702 3.4965
83 2DT9 THR 0.01382 0.431 3.59281
84 2WPB ZZI 0.01531 0.43306 3.61842
85 3GEG NAD 0.003165 0.41386 3.64372
86 3A25 SAM 0.0006708 0.46996 3.65448
87 1JG3 ADN 0.00007306 0.51442 3.67454
88 5THY SAH 0.008938 0.4117 3.67454
89 2EJU SAH 0.0006525 0.47051 3.7037
90 3F8D FAD 0.008153 0.40467 3.71517
91 2HNK SAH 0.0004689 0.46864 3.76569
92 1ZEM NAD 0.003816 0.41327 3.81679
93 3RKR NAP 0.02818 0.41073 3.81679
94 4CNK FAD 0.001641 0.40738 3.83632
95 1Q0S SAH 0.000425 0.45899 3.861
96 2PWY SAH 0.0003511 0.46624 3.87597
97 1I9G SAM 0.000164 0.48891 3.93701
98 1P77 ATR 0.004421 0.46232 3.93701
99 1ZMD NAI 0.003493 0.41761 3.93701
100 1O0S NAI 0.007626 0.40895 3.93701
101 4D79 ATP 0.002364 0.44467 3.98551
102 3LST SAH 0.01372 0.41931 4.02299
103 5CQG 55C 0.03165 0.41125 4.02685
104 2WET FAD 0.0003695 0.40968 4.10959
105 2HMT NAI 0.0003463 0.47041 4.16667
106 2WE0 UMP 0.03445 0.40617 4.1958
107 3KLJ FAD 0.0007588 0.42443 4.19948
108 4MIG G3F 0.002401 0.41126 4.19948
109 1VQW FAD 0.002628 0.40454 4.19948
110 3UDZ ADP 0.01844 0.40332 4.19948
111 2GVC FAD 0.003132 0.40173 4.19948
112 4R6W SAH 0.0002649 0.44421 4.26357
113 2BQP GLC 0.02315 0.4176 4.2735
114 5DXA SFG 0.00018 0.47865 4.29799
115 5DX1 SFG 0.0001519 0.47389 4.29799
116 5DX8 SFG 0.0002512 0.47246 4.29799
117 5DWQ SFG 0.0002346 0.46984 4.29799
118 5DX0 SFG 0.0001936 0.46954 4.29799
119 5HTX ADP 0.04365 0.40077 4.32802
120 2VSU ACO 0.02111 0.40357 4.36364
121 3A4T SFG 0.0001484 0.48646 4.37956
122 4QTU SAM 0.0001218 0.4993 4.44444
123 1JZN BGC GAL 0.01848 0.44879 4.44444
124 5K7U SAM 0.003313 0.4379 4.44444
125 1X87 NAD 0.00003517 0.50901 4.46194
126 2UYQ SAM 0.0131 0.43664 4.46194
127 1OFL NGK GCD 0.03978 0.41333 4.46194
128 1WDK NAD 0.007603 0.409 4.46194
129 5EB4 FAD 0.002359 0.40392 4.46194
130 3B8I OXL 0.02562 0.42974 4.52962
131 1N2X SAM 0.003892 0.42149 4.65116
132 1VBO MAN MAN MAN 0.03808 0.41044 4.69799
133 1VBO MAN 0.03573 0.4095 4.69799
134 3MB5 SAM 0.0005303 0.45857 4.70588
135 5IL1 SAM 0.00181 0.45004 4.71698
136 4EUE NAI 0.0005161 0.43337 4.72441
137 5SYN 71T 0.00853 0.42225 4.72441
138 1KPG SAH 0.01085 0.40509 4.87805
139 1TPY SAH 0.0109 0.40501 4.87805
140 3OJO NAD 0.003066 0.42592 4.98688
141 3S5W FAD 0.001472 0.4189 4.98688
142 2XVF FAD 0.001151 0.40681 4.98688
143 4TM3 FAD 0.00753 0.40482 4.98688
144 3FZG SAM 0.00641 0.43178 5
145 1GZ6 NAI 0.002791 0.40832 5.01567
146 3BXO SAM 0.002717 0.454 5.02092
147 4AVB CMP 0.0258 0.40911 5.1051
148 4Y2H SAH 0.0009994 0.41617 5.11364
149 4Y2H 49K 0.001376 0.41122 5.11364
150 3FUU ADN 0.0001394 0.49664 5.16605
151 1XHC FAD 0.0007601 0.41685 5.17711
152 1GR0 NAD 0.002261 0.40462 5.17711
153 4M37 SAH 0.00008382 0.50665 5.24781
154 1Y8Q ATP 0.0001427 0.47892 5.24934
155 1RP0 AHZ 0.0006561 0.40757 5.24934
156 2VDV SAM 0.0004744 0.49128 5.28455
157 1R18 SAH 0.0004822 0.46414 5.28634
158 1ZGA SAH 0.005832 0.43766 5.32213
159 2NVK NAP 0.04907 0.40532 5.32787
160 1JNR FAD 0.005007 0.41467 5.33333
161 3MMH SME 0.03691 0.4046 5.38922
162 1V59 NAD 0.00008872 0.53322 5.51181
163 4DMG SAM 0.0002894 0.50741 5.51181
164 1VJT NAD 0.003042 0.436 5.51181
165 1OBB NAD 0.002478 0.42677 5.51181
166 5M58 SAH 0.006636 0.42063 5.51181
167 1U1I NAD 0.001276 0.41365 5.51181
168 5F8F SFG 0.001997 0.45619 5.57029
169 3K0T BGC 0.04033 0.40665 5.59441
170 5ULP KB1 0.0002209 0.47094 5.59701
171 5BW4 SAM 0.0006829 0.474 5.61798
172 5DLY SAH 0.001512 0.40296 5.6391
173 5N53 8NB 0.04488 0.4077 5.64103
174 5HJM MTA 0.0002789 0.48301 5.68182
175 1O94 ADP 0.01045 0.40043 5.68182
176 2PEH LYS ARG LYS SER ARG TRP ASP GLU THR PRO 0.04294 0.40115 5.71429
177 1V6A TRE 0.01883 0.42962 5.72289
178 2HYR BGC GLC 0.01771 0.41848 5.7377
179 2NUO BGC 0.03495 0.40187 5.7377
180 2GUD BMA 0.04885 0.40072 5.7377
181 2GUC MAN 0.04168 0.40051 5.7377
182 1E3W NAD 0.00409 0.40439 5.74713
183 4C4A SAH 0.00002592 0.52973 5.77428
184 2PXX SAH 0.001421 0.45098 5.77428
185 5MPT SAH 0.001782 0.45035 5.77428
186 2NXE SAM 0.005641 0.4272 5.77428
187 4EJN 0R4 0.01651 0.40555 5.77428
188 3UOY NAP 0.008407 0.40237 5.77428
189 2XYQ SAH 0.0001212 0.50427 5.86207
190 1XDS SAM 0.002459 0.45614 5.88235
191 3Q87 SAM 0.006116 0.41306 5.88235
192 5F7J ADE 0.02076 0.42758 5.9375
193 3GXO SAH 0.01302 0.42044 5.96206
194 2FK8 SAM 0.008109 0.41359 5.97484
195 2BZG SAH 0.0006866 0.46949 6.03448
196 4KRG SAH 0.000925 0.46779 6.03675
197 3SSO SAH 0.00795 0.41397 6.03675
198 4A3R CIT 0.02385 0.4074 6.03675
199 4FK7 P34 0.03058 0.41755 6.11354
200 5KVA SAM 0.001159 0.44753 6.11511
201 4WNB 4BN 0.024 0.40092 6.20155
202 3P2E SAH 0.009106 0.41134 6.22222
203 1L3I SAH 0.0001575 0.46951 6.25
204 4PNE SAH 0.009402 0.40504 6.29139
205 3G89 SAM 0.001448 0.46746 6.29921
206 4AZT SAM 0.004595 0.43133 6.29921
207 2QA1 FAD 0.0008986 0.4167 6.29921
208 3EGI ADP 0.00002387 0.58487 6.31068
209 5IDB BMA 0.01493 0.42903 6.33803
210 5IDB MAN 0.01493 0.42903 6.33803
211 2YVJ NAI 0.004213 0.43307 6.42202
212 5LOG SAH 0.000289 0.48231 6.43777
213 3H8V ATP 0.0007147 0.46868 6.50685
214 3UCL NAP 0.003412 0.41811 6.56168
215 3UCL CYH 0.003318 0.41663 6.56168
216 3UCL FAD 0.003318 0.41663 6.56168
217 3GU3 SAH 0.00118 0.48191 6.69014
218 5XVQ SAH 0.00151 0.43911 6.69014
219 5XVK SAH 0.002034 0.43356 6.69014
220 3VC1 SAH 0.01015 0.40636 6.73077
221 3ICT ADP 0.001473 0.47187 6.82415
222 3ICS ADP 0.001798 0.46751 6.82415
223 1P31 EPU 0.005048 0.42944 6.82415
224 3ICR FAD 0.001301 0.40981 6.82415
225 3ICT FAD 0.001236 0.40526 6.82415
226 1MUU NAD 0.008577 0.40145 6.82415
227 5FA8 SAM 0.0005765 0.45702 6.8323
228 1KYZ SAH 0.009901 0.41588 6.84932
229 4XUC 43G 0.0002368 0.44021 6.88073
230 4XUC SAM 0.0002368 0.44021 6.88073
231 1G60 SAM 0.001301 0.45271 6.92308
232 4RDH AMP 0.0008321 0.47449 6.94444
233 4RDI ATP 0.001262 0.45728 6.94444
234 4RL4 PPV 0.02278 0.40439 7.07547
235 1WY7 SAH 0.0005464 0.46177 7.08661
236 1DL5 SAH 0.000147 0.41063 7.08661
237 2H7C SIA 0.04622 0.40844 7.08661
238 1RJD SAM 0.01239 0.40536 7.08661
239 1LSS NAD 0.000156 0.48988 7.14286
240 4X60 SFG 0.0005309 0.41135 7.14286
241 4X60 3XV 0.0005251 0.40815 7.14286
242 3X0D SAH 0.0000455 0.51866 7.17557
243 4NEC SAH 0.0009989 0.47068 7.19697
244 1NU4 MLA 0.03352 0.41895 7.2165
245 5HS2 CTP 0.02028 0.40757 7.32759
246 1ZQ9 SAM 0.00006065 0.51816 7.34908
247 1N4W FAD 0.0003283 0.40543 7.53968
248 2P41 SAH 0.0001959 0.49465 7.54098
249 1G55 SAH 0.001106 0.45592 7.61155
250 2RGO FAD 0.00148 0.40305 7.61155
251 3VY6 BGC BGC 0.02234 0.41672 7.80142
252 5ITV NAI 0.00273 0.40869 7.84314
253 1UAY ADN 0.00384 0.4466 7.85124
254 3DXY SAM 0.0002966 0.50687 7.87402
255 2JJQ SAH 0.0002464 0.50527 7.87402
256 2GAG NAD 0.001468 0.40328 7.87402
257 1VE3 SAM 0.008059 0.42003 7.92952
258 3EVG SAH 0.000252 0.48959 8
259 4POO SAM 0.001295 0.43864 8
260 5JGL SAM 0.01082 0.41736 8.13648
261 2YX1 SFG 0.00007641 0.53027 8.33333
262 1CM0 COA 0.02575 0.40574 8.33333
263 1OFS SUC 0.04549 0.40416 8.33333
264 3S1S SAH 0.001047 0.44593 8.39895
265 5WGR FAD 0.0004739 0.40952 8.39895
266 4KOA NDP 0.008233 0.42298 8.40841
267 2DPM SAM 0.001617 0.44122 8.4507
268 5MGZ SAH 0.003596 0.4327 8.66142
269 5FIT AP2 0.03859 0.40018 8.84354
270 3BGD SAH 0.000835 0.45013 8.84615
271 3BGD PM6 0.001581 0.42591 8.84615
272 5D4V SAH 0.01167 0.4037 8.95522
273 4YMH SAH 0.0005026 0.4673 9.16667
274 5E9W SAH 0.0003587 0.50272 9.18635
275 5E8J SAH 0.00056 0.48774 9.18635
276 4ONQ SFG 0.003016 0.43979 9.18635
277 4Y4V DAL 0.03054 0.40312 9.43953
278 3SQP FAD 0.006302 0.43729 9.44882
279 1Z3C SA8 0.001541 0.42079 9.44882
280 1YKJ FAD 0.007366 0.40205 9.44882
281 4II2 ATP 0.001132 0.45163 9.63855
282 3LKZ SFG 0.0001579 0.4942 9.65732
283 2HXW FLC 0.0439 0.408 9.70464
284 1XTP SAI 0.006277 0.42506 9.84252
285 5L95 AMP 0.0002137 0.48825 9.97375
286 1SQF SAM 0.0006435 0.47079 9.97375
287 2D2I NAP 0.008443 0.40705 9.97375
288 3EGV SAH 0.006253 0.42862 10.2041
289 3LCC SAH 0.001033 0.46553 10.2128
290 5E1M SAH 0.00146 0.41153 10.2362
291 5E1M PRO PRO LYS ARG ILE ALA 0.00146 0.41153 10.2362
292 5DYO FLU 0.03735 0.40967 10.2362
293 4E13 NAD 0.01025 0.40904 10.2473
294 3CBG SAH 0.000106 0.51213 10.3448
295 4DCM SAM 0.0009494 0.47174 10.4
296 4RYV ZEA 0.03216 0.40773 10.4987
297 1DCP HBI 0.03567 0.40139 10.5769
298 1GXS DKA 0.04062 0.41057 10.7595
299 3I53 SAH 0.01036 0.40884 10.8434
300 4M73 M72 0.001546 0.40253 10.9792
301 3WV8 ATP 0.0003283 0.4798 11.0092
302 3OU2 SAH 0.002023 0.42742 11.4679
303 3C3Y SAH 0.001227 0.45386 11.8143
304 1KYQ NAD 0.0005471 0.47854 12.336
305 5JE0 SAH 0.001585 0.41768 12.336
306 5JE0 AZ8 0.001585 0.41768 12.336
307 2HK9 ATR 0.01529 0.42453 13.0909
308 1XCL SAH 0.0003564 0.43939 16.0105
309 1P1C SAH 0.0002524 0.47237 16.0804
310 4KXQ APR 0.01163 0.40378 16.726
311 5KOK SAH 0.003648 0.43242 17.8478
312 1FAO 4IP 0.03629 0.41255 18.254
313 2V3B FAD 0.0005996 0.41682 20
314 1QAN SAH 0.0001305 0.48889 20.4918
315 4FE2 AIR 0.03851 0.40363 20.7349
316 2PT9 S4M 0.00000000002236 0.75615 21.1838
317 2PT9 2MH 0.00000000001738 0.69914 21.1838
318 1QZZ SAM 0.01353 0.41961 21.2598
319 3AB4 THR 0.01938 0.42319 21.3483
320 2DTJ THR 0.02571 0.41281 21.9101
321 1LES GLC FRU 0.01483 0.423 23.0769
322 2E1A MSE 0.04091 0.40584 24
323 2I7C AAT 0.0000000001049 0.67725 24.0283
324 1JQ3 AAT 0.0000000001683 0.66967 29.0541
325 3G2O SAM 0.004765 0.4306 29.097
326 2F5Z FAD 0.001587 0.41317 29.6875
327 2O07 MTA 0.0000000001111 0.71156 30.5921
328 2O07 SPD 0.000000000144 0.69243 30.5921
329 4YUW 4JU 0.000000004023 0.40134 36.1842
330 4GQB 0XU 0.00006733 0.49263 40.9091
331 4M38 SAH 0.0001111 0.49643 42.8571
332 5FA5 MTA 0.00002302 0.54946 45
Pocket No.: 5; Query (leader) PDB : 3C6K; Ligand: MTA; Similar sites found: 28
This union binding pocket(no: 5) in the query (biounit: 3c6k.bio2) has 35 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2UVO NAG 0.03926 0.40374 1.16959
2 4UP4 NDG 0.01162 0.41719 2.09974
3 1ELI PYC 0.001789 0.41061 2.09974
4 5K8P 6R8 0.04595 0.40117 2.09974
5 1PL6 NAD 0.01404 0.40081 2.62467
6 4RQU NAD 0.004823 0.40175 2.66667
7 5GM1 SAH 0.01079 0.4003 2.6936
8 1KZL CRM 0.02595 0.41055 2.88462
9 3B9Q MLI 0.04121 0.41481 2.98013
10 1J3R 6PG 0.03079 0.40669 3.15789
11 2B4R AES 0.004463 0.40063 3.18841
12 5AOG IAC 0.01458 0.40187 3.25733
13 4PAB THG 0.02613 0.40016 3.67454
14 1EI6 PPF 0.048 0.40556 4.19948
15 3P3Z P3Z 0.02531 0.42166 4.80769
16 1PIG GLC GLC 0.04096 0.41087 4.83871
17 3NTD FAD 0.002667 0.40425 4.98688
18 2IVD FAD 0.001577 0.40049 4.98688
19 2REG CHT 0.03252 0.41386 5.03356
20 5FTW SAH 0.01213 0.40362 5.46875
21 4YEE 4CQ 0.04301 0.40871 5.55556
22 1MZC SUC 0.04395 0.4022 6.29921
23 3ML5 AZM 0.04357 0.40759 6.3197
24 2D3Y DU 0.0392 0.40264 7.30594
25 5KMS FAD 0.001502 0.40152 8.14815
26 2Y6Q FAD 0.003156 0.40157 8.66142
27 4I5I 4I5 0.03611 0.40309 12.336
28 3H0L ADP 0.03826 0.40179 15.9574
Pocket No.: 6; Query (leader) PDB : 3C6K; Ligand: SPD; Similar sites found: 40
This union binding pocket(no: 6) in the query (biounit: 3c6k.bio2) has 35 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4Q3F TLA 0.03069 0.40307 None
2 2UVO NAG 0.03926 0.40374 1.16959
3 3LXD FAD 0.001645 0.40845 1.31234
4 4UP4 NDG 0.01162 0.41719 2.09974
5 1ELI PYC 0.001789 0.41061 2.09974
6 5K8P 6R8 0.04595 0.40117 2.09974
7 3CTY FAD 0.003138 0.40769 2.50784
8 1PL6 NAD 0.01404 0.40081 2.62467
9 4RQU NAD 0.004823 0.40175 2.66667
10 5GM1 SAH 0.01079 0.4003 2.6936
11 1KZL CRM 0.02595 0.41055 2.88462
12 1J2Z SOG 0.03235 0.41392 2.96296
13 3B9Q MLI 0.04121 0.41481 2.98013
14 2B4R AES 0.004463 0.40063 3.18841
15 3NUG NAD 0.001311 0.40349 3.23887
16 5AOG IAC 0.01458 0.40187 3.25733
17 4LWP SAH 0.00002956 0.40619 3.53261
18 1RYI FAD 0.003056 0.40521 3.93701
19 1EI6 PPF 0.048 0.40556 4.19948
20 3VSE SAH 0.00001038 0.40248 4.19948
21 3NT6 FAD 0.002651 0.40435 4.46194
22 4USQ FAD 0.001734 0.40639 4.72441
23 1PIG GLC GLC 0.04096 0.41087 4.83871
24 3NTD FAD 0.002667 0.40425 4.98688
25 2IVD FAD 0.001577 0.40049 4.98688
26 2REG CHT 0.03252 0.41386 5.03356
27 2Q1S NAI 0.003534 0.40482 5.03979
28 1I1N SAH 0.0005305 0.40793 5.30973
29 5FTW SAH 0.01213 0.40362 5.46875
30 1KC7 PPR 0.04652 0.40457 5.51181
31 4YEE 4CQ 0.04301 0.40871 5.55556
32 1MZC SUC 0.04395 0.4022 6.29921
33 3GRU AMP 0.0002426 0.40566 6.44068
34 4USR FAD 0.001328 0.40783 6.82415
35 3LAD FAD 0.00288 0.40716 7.08661
36 5KMS FAD 0.001502 0.40152 8.14815
37 2Y6Q FAD 0.003156 0.40157 8.66142
38 4I5I 4I5 0.03611 0.40309 12.336
39 3AD8 NAD 0.001663 0.40704 15.2709
40 3H0L ADP 0.03826 0.40179 15.9574
Pocket No.: 7; Query (leader) PDB : 3C6K; Ligand: SPD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 3c6k.bio2) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 3C6K; Ligand: MTA; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 3c6k.bio2) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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