Receptor
PDB id Resolution Class Description Source Keywords
5X62 2.2 Å EC: 2.1.1.22 CRYSTAL STRUCTURE OF A CARNOSINE N-METHYLTRANSFERASE BOUND B SACCHAROMYCES CEREVISIAE (STRAIN ATCC S288C) METHYLTRANSFERASE SAM ROSSMANN FOLD TRANSFERASE
Ref.: SUBSTRATE RECOGNITION MECHANISM OF THE PUTATIVE YEA CARNOSINE N-METHYLTRANSFERASE ACS CHEM. BIOL. V. 12 2164 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NA B:502;
Part of Protein;
none;
submit data
22.99 Na [Na+]
SAH B:501;
A:501;
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
5X62 2.2 Å EC: 2.1.1.22 CRYSTAL STRUCTURE OF A CARNOSINE N-METHYLTRANSFERASE BOUND B SACCHAROMYCES CEREVISIAE (STRAIN ATCC S288C) METHYLTRANSFERASE SAM ROSSMANN FOLD TRANSFERASE
Ref.: SUBSTRATE RECOGNITION MECHANISM OF THE PUTATIVE YEA CARNOSINE N-METHYLTRANSFERASE ACS CHEM. BIOL. V. 12 2164 2017
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5X62 - 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 5X62 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
50% 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 5X62 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: SAH; Similar ligands found: 197
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 SXZ 0.692308 0.916667
6 DSH 0.692308 0.914286
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 RAB 0.573333 0.84058
19 ADN 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 SSA 0.536842 0.712644
28 SMM 0.536842 0.88
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 AMP 0.529412 0.763158
36 A 0.529412 0.763158
37 5CA 0.525773 0.712644
38 ME8 0.524752 0.8125
39 M2T 0.52439 0.821918
40 6RE 0.523256 0.824324
41 GJV 0.522727 0.813333
42 AAT 0.515789 0.863014
43 LSS 0.515152 0.696629
44 KAA 0.514852 0.727273
45 J7C 0.511364 0.835616
46 A5A 0.510417 0.697674
47 SON 0.505495 0.805195
48 SRP 0.505155 0.805195
49 5AL 0.5 0.779221
50 VMS 0.5 0.681818
51 KH3 0.5 0.866667
52 ADX 0.5 0.694118
53 CA0 0.5 0.769231
54 AMP MG 0.5 0.74359
55 AMO 0.5 0.805195
56 54H 0.5 0.681818
57 AHX 0.49505 0.753086
58 TSB 0.494949 0.689655
59 53H 0.494949 0.674157
60 G5A 0.494737 0.712644
61 A2D 0.494382 0.74359
62 ABM 0.494382 0.74359
63 ZAS 0.494253 0.808219
64 A6D 0.490196 0.759494
65 8QN 0.49 0.779221
66 GEK 0.49 0.956522
67 GAP 0.489583 0.769231
68 A3S 0.48913 0.884058
69 AN2 0.48913 0.734177
70 S4M 0.488889 0.831169
71 SRA 0.488636 0.746835
72 LAD 0.485437 0.810127
73 52H 0.484848 0.674157
74 A12 0.483516 0.759494
75 BA3 0.483516 0.74359
76 AP2 0.483516 0.759494
77 AOC 0.483146 0.842857
78 NEC 0.483146 0.788732
79 Y3J 0.481481 0.768116
80 NVA LMS 0.480392 0.696629
81 VRT 0.479167 0.861111
82 50T 0.478723 0.734177
83 5AS 0.478261 0.655556
84 B4P 0.478261 0.74359
85 ADP 0.478261 0.74359
86 AP5 0.478261 0.74359
87 A3N 0.477778 0.830986
88 YSA 0.476636 0.712644
89 XAH 0.476636 0.768293
90 0XU 0.473684 0.897059
91 WAQ 0.471154 0.807692
92 NSS 0.470588 0.712644
93 5AD 0.468354 0.791045
94 ADP MG 0.468085 0.734177
95 AU1 0.468085 0.725
96 M33 0.468085 0.734177
97 MAO 0.467391 0.797468
98 TXA 0.466667 0.759494
99 A3G 0.466667 0.871429
100 NB8 0.466667 0.775
101 3AM 0.465909 0.727273
102 DAL AMP 0.465347 0.779221
103 ATP 0.463158 0.74359
104 ADP BEF 0.463158 0.716049
105 A3T 0.463158 0.842857
106 BEF ADP 0.463158 0.716049
107 ACP 0.463158 0.746835
108 7D7 0.4625 0.785714
109 LEU LMS 0.461538 0.677778
110 APC 0.458333 0.759494
111 AQP 0.458333 0.74359
112 APR 0.458333 0.766234
113 PRX 0.458333 0.746835
114 AR6 0.458333 0.766234
115 5FA 0.458333 0.74359
116 IOT 0.456897 0.761905
117 4AD 0.456311 0.794872
118 PAJ 0.456311 0.722892
119 WSA 0.45614 0.72093
120 FA5 0.453704 0.805195
121 YAP 0.453704 0.794872
122 RBY 0.453608 0.782051
123 ADV 0.453608 0.782051
124 ADP PO3 0.453608 0.763158
125 AD9 0.453608 0.725
126 SAP 0.453608 0.728395
127 AGS 0.453608 0.728395
128 PTJ 0.45283 0.731707
129 MHZ 0.452632 0.797468
130 00A 0.451923 0.740741
131 A3P 0.451613 0.74026
132 YLP 0.451327 0.771084
133 7MD 0.45045 0.768293
134 ALF ADP 0.45 0.707317
135 ADP ALF 0.45 0.707317
136 ATP MG 0.44898 0.734177
137 2VA 0.447917 0.819444
138 OOB 0.446602 0.779221
139 ANP 0.444444 0.725
140 ACQ 0.444444 0.746835
141 TAT 0.444444 0.7375
142 P5A 0.443396 0.719101
143 7D5 0.443182 0.708861
144 ARG AMP 0.442478 0.759036
145 A1R 0.442308 0.7625
146 YLC 0.439655 0.790123
147 2AM 0.438202 0.717949
148 DLL 0.438095 0.779221
149 A22 0.436893 0.734177
150 D3Y 0.436893 0.859155
151 TYR AMP 0.436364 0.782051
152 ATF 0.435644 0.716049
153 MYR AMP 0.435185 0.746988
154 SO8 0.434343 0.808219
155 3UK 0.433962 0.769231
156 OAD 0.433962 0.769231
157 TAD 0.433628 0.765432
158 25A 0.432692 0.74359
159 ANP MG 0.431373 0.707317
160 VO4 ADP 0.431373 0.734177
161 ADP VO4 0.431373 0.734177
162 9SN 0.431193 0.731707
163 TYM 0.431034 0.805195
164 PR8 0.429907 0.8
165 ADQ 0.428571 0.746835
166 YLB 0.42735 0.771084
167 3OD 0.425926 0.769231
168 FYA 0.425926 0.779221
169 1ZZ 0.425926 0.746988
170 PPS 0.425743 0.674419
171 NVA 2AD 0.424242 0.808219
172 MAP 0.423077 0.707317
173 A2P 0.421053 0.727273
174 4YB 0.421053 0.735632
175 ADP BMA 0.420561 0.746835
176 5SV 0.419048 0.731707
177 3NZ 0.416667 0.824324
178 YLA 0.416667 0.771084
179 48N 0.413793 0.753086
180 LPA AMP 0.413793 0.768293
181 AYB 0.413223 0.761905
182 QQY 0.413043 0.696203
183 ACK 0.413043 0.710526
184 JB6 0.412844 0.7625
185 BIS 0.412844 0.719512
186 PAP 0.41 0.730769
187 OVE 0.408602 0.7125
188 4UV 0.40708 0.75
189 AMP DBH 0.40708 0.746835
190 3AD 0.406977 0.852941
191 AF3 ADP 3PG 0.40678 0.743902
192 OMR 0.40678 0.738095
193 LAQ 0.405172 0.768293
194 A A 0.40367 0.74359
195 7C5 0.403509 0.789474
196 7MC 0.403361 0.75
197 4UU 0.4 0.75
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5X62; Ligand: SAH; Similar sites found: 490
This union binding pocket(no: 1) in the query (biounit: 5x62.bio1) has 20 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1MAI I3P 0.02078 0.40398 None
2 3GWZ SAH 0.00000864 0.51222 0.813008
3 3GXO SAH 0.00004107 0.49227 0.813008
4 3OND ADN 0.0157 0.4196 0.985222
5 3OND NAD 0.0157 0.4196 0.985222
6 1S7G NAD 0.002363 0.44236 1.18577
7 1S7G APR 0.002861 0.44108 1.18577
8 2Z3Y F2N 0.01584 0.4161 1.23153
9 2VVM FAD 0.01943 0.40915 1.23153
10 2V3A FAD 0.02638 0.4009 1.30208
11 3TKY SAH 0.000007366 0.53693 1.3587
12 5JGL SAM 0.000009893 0.52589 1.38408
13 3A4T SFG 0.00006767 0.45621 1.45985
14 5MPT SAH 0.0001018 0.48424 1.47783
15 4X9M FAD 0.008498 0.42639 1.47783
16 5MZI FAD 0.03206 0.41121 1.47783
17 5MZI FYK 0.03297 0.41121 1.47783
18 3GMB FAD 0.0156 0.40771 1.47783
19 3NTA FAD 0.02098 0.40566 1.47783
20 4RPL 3UC 0.006992 0.44893 1.50376
21 4RPL FAD 0.008794 0.44202 1.50376
22 1GY8 NAD 0.007498 0.4191 1.51134
23 3CTY FAD 0.009117 0.4286 1.5674
24 4LWP SAH 0.000004047 0.54568 1.63043
25 4KIB SAH 0.000005008 0.53878 1.68067
26 2RAB FAD 0.0008256 0.47901 1.72414
27 2RAB NAD 0.001718 0.47901 1.72414
28 5JJR SAH 0.0001675 0.46415 1.72414
29 4M52 FAD 0.002096 0.45752 1.72414
30 4YNU LGC 0.003571 0.45185 1.72414
31 4YNU FAD 0.003014 0.45185 1.72414
32 1MO9 FAD 0.01992 0.43125 1.72414
33 1MO9 KPC 0.02205 0.42946 1.72414
34 3TKA SAM 0.02542 0.40775 1.72911
35 3LCV SAM 0.0000299 0.51695 1.77936
36 1ELI PYC 0.0009452 0.46972 1.79949
37 3KLJ FAD 0.001981 0.44853 1.81818
38 5BUK FAD 0.005142 0.44064 1.97044
39 3CGD NAD 0.01521 0.43679 1.97044
40 3CGD FAD 0.01521 0.43679 1.97044
41 3CGD COA 0.01521 0.43679 1.97044
42 3SSO SAH 0.005806 0.43431 1.97044
43 3EYA FAD 0.005854 0.42887 1.97044
44 2R4J FAD 0.02036 0.41705 1.97044
45 2R4J 13P 0.02036 0.41705 1.97044
46 2RGJ FAD 0.01643 0.40554 1.99005
47 4NTC FAD 0.004771 0.43938 2.08955
48 3CH6 NAP 0.0081 0.44252 2.0979
49 3CH6 311 0.0081 0.44252 2.0979
50 3C3Y SAH 0.001785 0.4317 2.1097
51 3LKZ SFG 0.0003251 0.46435 2.18069
52 2A92 NAI 0.01946 0.40097 2.18069
53 1DL5 SAH 0.000007458 0.55049 2.2082
54 3L9W AMP 0.00008609 0.50896 2.21675
55 3L9W GSH 0.00007373 0.50876 2.21675
56 1SQF SAM 0.0004538 0.45577 2.21675
57 1COY FAD 0.003929 0.44343 2.21675
58 1COY AND 0.01125 0.43269 2.21675
59 2XVE FAD 0.01312 0.43136 2.21675
60 5I39 FAD 0.007101 0.42812 2.21675
61 3ICS FAD 0.00769 0.42648 2.21675
62 3ICR FAD 0.00753 0.42587 2.21675
63 2IID FAD 0.01557 0.42426 2.21675
64 2IID PHE 0.01557 0.42426 2.21675
65 1D4D FAD 0.01533 0.41678 2.21675
66 2V3V MGD 0.03391 0.41625 2.21675
67 4J36 FAD 0.01032 0.41503 2.21675
68 4Z24 FAD 0.01599 0.41503 2.21675
69 4J36 1HR 0.018 0.41341 2.21675
70 1E1M FAD 0.02862 0.41041 2.21675
71 1E1M NAP 0.02862 0.41041 2.21675
72 4DSG FAD 0.03494 0.40993 2.21675
73 4DSG UDP 0.03494 0.40993 2.21675
74 3ICT FAD 0.01951 0.40621 2.21675
75 5KMS NAD 0.01496 0.42719 2.22222
76 5KMS FAD 0.01245 0.41448 2.22222
77 4ITU 1HS 0.00674 0.43313 2.23048
78 4ITU NAI 0.004235 0.43313 2.23048
79 1IY8 NAD 0.01659 0.40305 2.24719
80 2A14 SAH 0.00005194 0.50406 2.28137
81 1U1I NAD 0.008021 0.4213 2.29592
82 2O07 SPD 0.0001381 0.49787 2.30263
83 2O07 MTA 0.0001168 0.49787 2.30263
84 5E72 SAM 0.00004337 0.50755 2.31214
85 4PNE SAH 0.000003837 0.55696 2.31788
86 2EFJ SAH 0.003351 0.44469 2.34375
87 5F8F SFG 0.000002823 0.54104 2.38727
88 1WY7 SAH 0.00005487 0.50299 2.41546
89 2EG5 SAH 0.0000009375 0.58583 2.41935
90 4RDI ATP 0.0006423 0.44916 2.43056
91 4RDH AMP 0.001185 0.4397 2.43056
92 4MO2 FDA 0.004553 0.43624 2.44565
93 4MO2 FAD 0.005266 0.4343 2.44565
94 1ZQ9 SAM 0.00002388 0.51186 2.45614
95 2Q7V FAD 0.007568 0.42976 2.46154
96 4KRG SAH 0.0000006716 0.5768 2.46305
97 1FEC FAD 0.001955 0.46281 2.46305
98 4JDR FAD 0.00244 0.45334 2.46305
99 2CDU FAD 0.004328 0.43618 2.46305
100 1N4W FAD 0.006112 0.4361 2.46305
101 1FL2 FAD 0.009164 0.42385 2.46305
102 3G5S FAD 0.01687 0.40922 2.46305
103 4EIP FAD 0.0342 0.4022 2.46305
104 4EIP K2C 0.0342 0.4022 2.46305
105 2Y6Q FAD 0.01525 0.40592 2.51256
106 2Y6Q I7T 0.02874 0.40592 2.51256
107 2CBZ ATP 0.01958 0.40119 2.53165
108 4D79 ATP 0.0005719 0.45137 2.53623
109 5E8J SAH 0.000001847 0.57239 2.5641
110 5E9W SAH 0.000001401 0.53699 2.5641
111 3RIY NAD 0.00304 0.43595 2.5641
112 2NYR SVR 0.0494 0.41165 2.58303
113 3QWI NAP 0.006882 0.42206 2.59259
114 3QWI CUE 0.01094 0.42206 2.59259
115 2PX8 SAH 0.003165 0.41875 2.60223
116 5ULP KB1 0.0000917 0.49712 2.61194
117 1XDS SAM 0.000001773 0.5732 2.6738
118 1QZZ SAM 0.00001268 0.53423 2.6738
119 3DUW SAH 0.00006782 0.49439 2.69058
120 1RJD SAM 0.000008487 0.53675 2.69461
121 2ZWA SAH 0.00004452 0.50704 2.70936
122 5FA5 MTA 0.0000198 0.50507 2.70936
123 5BVA FAD 0.001288 0.46969 2.70936
124 5JAQ NAI 0.002368 0.45187 2.70936
125 3S5W FAD 0.003444 0.43478 2.70936
126 1RSG FAD 0.0181 0.41242 2.70936
127 5MBX FAD 0.03097 0.40937 2.70936
128 5MBX SP5 0.03097 0.40937 2.70936
129 2NXE SAM 0.0002707 0.46562 2.75591
130 3VSE SAH 0.0001212 0.45708 2.76382
131 4BLW AMP 0.001736 0.45248 2.76817
132 4BLW SAH 0.002307 0.43712 2.76817
133 1EJ0 SAM 0.0001928 0.47208 2.77778
134 1WG8 SAM 0.00003057 0.51863 2.80702
135 4E70 N7I 0.0001467 0.49667 2.83505
136 3GCZ SAM 0.000111 0.48259 2.83688
137 5XLX SAH 0.006835 0.40406 2.83688
138 5HJM MTA 0.00004121 0.47878 2.84091
139 1FP2 SAH 0.005162 0.43144 2.84091
140 1IM8 SAI 0.01634 0.41713 2.86885
141 3LST SAH 0.007407 0.42405 2.87356
142 4X7Y SAH 0.01288 0.41866 2.91971
143 5TUK FAD 0.01091 0.40768 2.94118
144 1GET NAP 0.004303 0.46021 2.95567
145 1GET FAD 0.00406 0.46021 2.95567
146 5EB4 FAD 0.007421 0.42921 2.95567
147 2JB2 FAD 0.0127 0.41708 2.95567
148 2JB2 PHE 0.01329 0.41708 2.95567
149 2RGO FAD 0.01226 0.41582 2.95567
150 1G8K MGD 0.04049 0.41068 2.95567
151 1YY5 FAD 0.02165 0.41035 2.95567
152 3WQQ NDP 0.02567 0.40419 2.95567
153 3WQQ IB3 0.02567 0.40419 2.95567
154 5A3B APR 0.005745 0.41905 2.9703
155 5CUQ NSC 0.0000441 0.52404 2.99625
156 1I8T FAD 0.004257 0.43974 2.99728
157 4POO SAM 0.0009419 0.4515 3
158 3H8V ATP 0.003059 0.4194 3.08219
159 2FK8 SAM 0.00001081 0.53208 3.14465
160 5XVK SAH 0.00002986 0.51698 3.16901
161 5XVQ SAH 0.00004363 0.45744 3.16901
162 3X0D SAH 0.00001235 0.52703 3.20197
163 3SQP FAD 0.004447 0.48959 3.20197
164 3QVP FAD 0.003767 0.44624 3.20197
165 3GDN HBX 0.009679 0.43226 3.20197
166 3GDN FAD 0.007027 0.43226 3.20197
167 1YQZ FAD 0.01744 0.42452 3.20197
168 3IHG FAD 0.005467 0.42284 3.20197
169 1UP7 NAD 0.01293 0.40009 3.20197
170 3VYW SAM 0.00006734 0.46425 3.24675
171 2WA2 SAM 0.0003896 0.45637 3.26087
172 2P41 SAH 0.0001381 0.47844 3.27869
173 3CIF NAD 0.01104 0.40878 3.34262
174 3CIF G3H 0.01493 0.4075 3.34262
175 1JQ3 AAT 0.0003777 0.48211 3.37838
176 5DLY 5D7 0.00001816 0.55251 3.38346
177 5DLY SAH 0.00001583 0.55251 3.38346
178 3C6K SPD 0.0006886 0.47383 3.41207
179 3C6K MTA 0.0006886 0.47383 3.41207
180 1MRH FMC 0.01634 0.40816 3.42205
181 3LAD FAD 0.001169 0.4697 3.44828
182 1VQW FAD 0.004353 0.43257 3.44828
183 2GVC FAD 0.005018 0.42968 3.44828
184 4EMI NAD 0.01856 0.4238 3.44828
185 4EMI FAD 0.008751 0.4238 3.44828
186 4EMJ FAD 0.01188 0.41847 3.44828
187 1Q9I TEO 0.02267 0.41749 3.44828
188 1Q9I FAD 0.02267 0.41749 3.44828
189 2XVF FAD 0.01273 0.41505 3.44828
190 1G55 SAH 0.00002728 0.51184 3.49854
191 5KVA SAM 0.000151 0.48337 3.59712
192 3GJ0 GDP 0.007929 0.40284 3.61991
193 3EVG SAH 0.00007224 0.49078 3.63636
194 4ONQ SFG 0.000108 0.47231 3.64146
195 2YVJ FAD 0.01038 0.41926 3.66972
196 3G2O SAM 0.000001904 0.56004 3.67893
197 2ZIF SAM 0.00003002 0.51001 3.7037
198 1F3L SAH 0.0000004736 0.53351 3.73832
199 3O7W SAM 0.000002431 0.53534 3.7415
200 1XHC FAD 0.006646 0.42738 3.81471
201 5EZ7 FAD 0.02832 0.40034 3.82653
202 1KYZ FER 0.04975 0.40153 3.83562
203 1KYZ SAH 0.02972 0.40111 3.83562
204 5LOG SAH 0.000226 0.47132 3.86266
205 2PWY SAH 0.006861 0.43881 3.87597
206 2BZG SAH 0.000009525 0.52937 3.87931
207 1EFV FAD 0.002098 0.46888 3.92157
208 1EFV AMP 0.002167 0.46819 3.92157
209 4GQB 0XU 0.02702 0.43638 3.92465
210 2PZM NAD 0.01677 0.41489 3.93939
211 2PZM UDP 0.01677 0.41489 3.93939
212 3NDJ SAH 0.00001594 0.56413 3.94089
213 3NDJ JHZ 0.00001594 0.56413 3.94089
214 3PT9 SAH 0.00002281 0.51274 3.94089
215 2WPF FAD 0.00483 0.469 3.94089
216 2WPF WPF 0.005591 0.46707 3.94089
217 5HSA FAS 0.002748 0.45087 3.94089
218 4D7E FAD 0.002807 0.44505 3.94089
219 4RSL FAD 0.00282 0.44495 3.94089
220 4D04 NAP 0.00893 0.44105 3.94089
221 4D04 FAD 0.00893 0.44105 3.94089
222 3LXD FAD 0.005821 0.42899 3.94089
223 5JCM NAD 0.01666 0.42864 3.94089
224 5JCM FAD 0.01621 0.42864 3.94089
225 5JCM ISD 0.01724 0.42789 3.94089
226 5THY SAH 0.0001214 0.48546 3.95062
227 5THZ SAH 0.0001807 0.48191 3.95062
228 4Y2H 49K 0.000002828 0.59093 3.97727
229 4Y2H SAH 0.000003275 0.5879 3.97727
230 3EGV SAH 0.0004066 0.45556 4.08163
231 3QOX SAH 0.00001067 0.53703 4.18719
232 5U8U FAD 0.001663 0.47903 4.18719
233 1X87 NAD 0.0003245 0.47049 4.18719
234 4OPC PGT 0.03276 0.42898 4.18719
235 4OPC FDA 0.02908 0.42898 4.18719
236 3NTD FAD 0.0186 0.40818 4.18719
237 1P3D UMA 0.015 0.4 4.21053
238 1XCL SAH 0.00006319 0.51678 4.25532
239 5KOK SAH 0.0000005539 0.58652 4.28212
240 5KOK S9T 0.000004726 0.57253 4.28212
241 5KOK R9T 0.00001002 0.55561 4.28212
242 4FN4 NAD 0.001839 0.44603 4.33071
243 4M38 SAH 0.000004828 0.54762 4.37318
244 4M37 SAH 0.003971 0.44514 4.37318
245 5N5D SAM 0.00004561 0.50199 4.42478
246 3NKS FAD 0.007176 0.42687 4.4335
247 3NJ4 AFX 0.04805 0.42287 4.4335
248 3NJ4 NAD 0.04805 0.42287 4.4335
249 4ZCC FAD 0.005676 0.44365 4.46429
250 4ZCC NAI 0.005676 0.44365 4.46429
251 2EJU SAH 0.00001999 0.51525 4.49735
252 3I53 SAH 0.000006893 0.54075 4.51807
253 1L1E SAH 0.000009189 0.53521 4.52962
254 3WV8 ATP 0.003785 0.41728 4.58716
255 3BGD SAH 0.000005211 0.55099 4.61538
256 3BGD PM6 0.000008769 0.54928 4.61538
257 4TQG NDP 0.001434 0.44957 4.64396
258 3OID NDP 0.01307 0.41022 4.65116
259 4REP FAD 0.002282 0.45264 4.6798
260 4HA6 FAD 0.004616 0.44198 4.6798
261 4UCI SAM 0.006278 0.40756 4.6798
262 3GRU AMP 0.00007892 0.49804 4.74576
263 1JQD SAH 0.000006485 0.55912 4.79452
264 1JQD HSM 0.00001839 0.53265 4.79452
265 4NBU NAI 0.008548 0.41646 4.8
266 1DJL NAP 0.01394 0.4089 4.83092
267 2UYQ SAM 0.0002122 0.50567 4.83871
268 5DM1 SAH 0.000001197 0.60713 4.86891
269 5DM1 5D7 0.00000134 0.60635 4.86891
270 1KPH SAH 0.00001485 0.52832 4.87805
271 1KPG SAH 0.00001583 0.52709 4.87805
272 4BUZ NAD 0.01176 0.40619 4.87805
273 4BUZ OCZ 0.0142 0.40619 4.87805
274 4BUZ OAD 0.0142 0.40619 4.87805
275 1YC5 NCA 0.01209 0.40565 4.87805
276 4KRI SAH 0.00000007716 0.62734 4.92611
277 3S1S SAH 0.0003214 0.47068 4.92611
278 4MIG G3F 0.004557 0.44669 4.92611
279 1GPE FAD 0.004275 0.44543 4.92611
280 3E1T FAD 0.01948 0.41174 4.92611
281 1NM5 NAD 0.03067 0.40821 4.92611
282 1V8B NAD 0.01807 0.40679 4.92611
283 1NM5 NAP 0.03257 0.40621 4.92611
284 3F8D FAD 0.02658 0.42116 4.95356
285 2PT9 2MH 0.0004758 0.47879 4.98442
286 2PT9 S4M 0.03678 0.40563 4.98442
287 1P1C SAH 0.00007759 0.49838 5.02513
288 4M73 M72 0.00001187 0.55842 5.04451
289 4M73 SAH 0.0000122 0.55636 5.04451
290 5MW4 5JU 0.00004991 0.53292 5.08982
291 5F2K SAH 0.00003554 0.52839 5.16304
292 5F2K OCA 0.00003554 0.52839 5.16304
293 3A25 SAM 0.00003121 0.50677 5.17241
294 4XQC NAD 0.007597 0.43154 5.17241
295 4XQC 13D 0.01468 0.41856 5.17241
296 5G3U FDA 0.01236 0.41665 5.17241
297 3UCL CYH 0.04618 0.40609 5.17241
298 3UCL NAP 0.04969 0.40609 5.17241
299 3UCL FAD 0.04618 0.40609 5.17241
300 5G3U ITW 0.03164 0.40229 5.17241
301 3T7S SAM 0.0000005659 0.58315 5.22388
302 4PIO SAH 0.00002054 0.54267 5.26316
303 4PIO AVI 0.00002362 0.53826 5.26316
304 3GU3 SAH 0.000000009719 0.60497 5.28169
305 2BD0 NAP 0.004675 0.42989 5.32787
306 5GM1 SAH 0.000002746 0.56348 5.38721
307 1Q0S SAH 0.0001469 0.48789 5.40541
308 5DNK SAH 0.000001434 0.52323 5.41872
309 1BZL FAD 0.00952 0.45406 5.41872
310 4R6W SAH 0.0000008538 0.45629 5.42636
311 2DFV NAD 0.01129 0.407 5.4755
312 3MQ2 SAH 0.00004834 0.49587 5.50459
313 3FUU ADN 0.00002438 0.51399 5.53506
314 2OBF SAH 0.0002209 0.50443 5.53633
315 2OBF F83 0.0002209 0.50443 5.53633
316 1PNO NAP 0.01739 0.40089 5.55556
317 1TPY SAH 0.00001476 0.52844 5.57491
318 5BW4 SAM 0.00001081 0.52421 5.61798
319 3G89 SAM 0.00000006353 0.5988 5.62249
320 5J60 FAD 0.01855 0.41011 5.625
321 2IV2 MGD 0.004877 0.43373 5.66502
322 3WGT FAD 0.0061 0.43966 5.76369
323 3WGT QSC 0.006345 0.43966 5.76369
324 1V59 FAD 0.001484 0.46768 5.85774
325 1V59 NAD 0.001672 0.41422 5.85774
326 4N49 SAM 0.001019 0.44444 5.91133
327 5FJN BE2 0.007168 0.43454 5.91133
328 5FJN FAD 0.006493 0.43391 5.91133
329 4KP7 NAP 0.03029 0.40557 5.91133
330 4KP7 1UQ 0.02729 0.40461 5.91133
331 1JG3 ADN 0.00001182 0.52526 5.95745
332 3KU0 ADE 0.02301 0.40456 5.9761
333 5JCA FAD 0.02564 0.40509 5.98592
334 5JCA NDP 0.0486 0.40324 5.98592
335 3DMH GMP 0.00002484 0.52861 6.03675
336 3DMH SAM 0.00001666 0.52374 6.03675
337 4UP3 FAD 0.02806 0.40144 6.05096
338 1O97 AMP 0.004038 0.45404 6.06061
339 1O97 FAD 0.004038 0.45404 6.06061
340 4IWN GEK 0.00000001704 0.66249 6.11354
341 1U2Z SAH 0.00001513 0.53023 6.15764
342 2GAG NAD 0.004955 0.43449 6.17284
343 2GAG FAD 0.01028 0.42693 6.17284
344 2GAG FOA 0.01249 0.42281 6.17284
345 3AD8 NAD 0.003414 0.43871 6.18812
346 3AD8 FAD 0.0151 0.43141 6.18812
347 3AD8 PYC 0.0151 0.43141 6.18812
348 5FA8 SAM 0.000001206 0.5795 6.21118
349 3P2E SAH 0.00005809 0.49967 6.22222
350 5L95 AMP 0.0008552 0.44581 6.25
351 2HNK SAH 0.00008795 0.49168 6.27615
352 3FRH SAH 0.00002089 0.52394 6.32411
353 4DMG SAM 0.0002097 0.48437 6.36132
354 4AZW SAM 0.00001902 0.51875 6.36943
355 2BRY FAD 0.002773 0.44172 6.40394
356 4TXI FAD 0.002763 0.44052 6.40394
357 3AYI FAD 0.006864 0.44037 6.40394
358 3AYI HCI 0.007113 0.44037 6.40394
359 4IV9 FAD 0.007473 0.42907 6.40394
360 3ZG6 APR 0.00861 0.40324 6.41892
361 4XUC 43G 0.00005843 0.52142 6.42202
362 4XUC SAM 0.00005843 0.52142 6.42202
363 1M2K APR 0.005812 0.42025 6.4257
364 4HSU FAD 0.02805 0.40485 6.45161
365 4GUT FAD 0.03118 0.40418 6.45161
366 2CUL FAD 0.02094 0.40272 6.46552
367 1G16 GDP 0.006975 0.40732 6.47059
368 2PXX SAH 0.0000058 0.54151 6.51163
369 1PR9 NAP 0.004341 0.43262 6.55738
370 3D3W NAP 0.005992 0.42608 6.55738
371 1VE3 SAM 0.00001534 0.50706 6.60793
372 3GDH SAH 0.00001658 0.46148 6.639
373 4EUE NAI 0.003407 0.43629 6.65025
374 3Q9T FAY 0.01864 0.40715 6.65025
375 1Z3C SA8 0.0000004697 0.61167 6.71141
376 5MGZ SAH 0.0000006444 0.58362 6.77966
377 2YX1 SFG 0.00001783 0.49964 6.84524
378 1NW5 SAM 0.0002343 0.47063 6.89655
379 1PN0 IPH 0.006274 0.4399 6.89655
380 1PN0 FAD 0.006032 0.4399 6.89655
381 4YAG NAI 0.006062 0.43534 6.92042
382 3AB1 FAD 0.005213 0.43655 6.94444
383 4LH7 1X8 0.0138 0.41763 7.12074
384 3UOY FAD 0.01389 0.43383 7.14286
385 3UOY NAP 0.01389 0.43383 7.14286
386 1XKQ NDP 0.008127 0.41989 7.14286
387 1QHH ATP 0.01111 0.40372 7.18563
388 3LCC SAH 0.0000001513 0.60501 7.23404
389 3TLJ SAH 0.0000143 0.47424 7.23861
390 4CVN ADP 0.003563 0.44168 7.29927
391 2VDV SAM 0.0000003226 0.60696 7.31707
392 3H2B SAH 0.000001759 0.56437 7.38916
393 4AZT SAM 0.000008397 0.53177 7.38916
394 5M67 3D1 0.02062 0.41456 7.38916
395 5M67 NAD 0.02187 0.4133 7.38916
396 5M67 ADE 0.02358 0.41169 7.38916
397 5M58 SAH 0.00000173 0.5647 7.3913
398 5ITV NAI 0.005836 0.42415 7.45098
399 3TNF GNP 0.01016 0.40774 7.47126
400 1XTP SAI 0.00000429 0.54457 7.48031
401 2VPY MGD 0.02652 0.41781 7.50988
402 4C3Y ANB 0.02143 0.41219 7.63547
403 4C3Y FAD 0.01779 0.4119 7.63547
404 3EGI ADP 0.000007165 0.57783 7.76699
405 1Y8Q ATP 0.0001091 0.43992 7.80347
406 1L3I SAH 0.01051 0.43416 7.8125
407 1E6E FAD 0.01698 0.40807 7.8125
408 4C4A SAH 0.000001601 0.56618 7.88177
409 5E1M SAH 0.00003454 0.53211 7.88382
410 5E1M PRO PRO LYS ARG ILE ALA 0.00003454 0.53211 7.88382
411 4FZV SAM 0.0002574 0.47098 7.94979
412 2V6G NAP 0.009329 0.41469 7.96703
413 4DCM SAM 0.0001968 0.46304 8
414 5DX0 SFG 0.000003008 0.56628 8.02292
415 5DWQ SFG 0.000002792 0.56549 8.02292
416 5DX1 SFG 0.000003257 0.56471 8.02292
417 5DX8 SFG 0.000002969 0.56195 8.02292
418 5DXA SFG 0.000002499 0.49987 8.02292
419 3ZNN FAD 0.006431 0.44475 8.06916
420 3ZNN 4WL 0.006431 0.44475 8.06916
421 2DPM SAM 0.00002932 0.51514 8.09859
422 3QFA FAD 0.002054 0.45794 8.12808
423 1BC5 SAH 0.004784 0.41803 8.17844
424 2AOT SAH 0.00000108 0.55835 8.21918
425 4YUW 4JU 0.003404 0.47972 8.22368
426 4YUW S4M 0.003337 0.47972 8.22368
427 3OU2 SAH 0.000008178 0.46788 8.25688
428 4NEC SAH 0.000006743 0.52478 8.33333
429 4YRY FAD 0.01571 0.41539 8.33333
430 4YRY NAD 0.04147 0.40234 8.33333
431 1KYQ NAD 0.003318 0.41581 8.39416
432 1NV8 SAM 0.0000388 0.52156 8.4507
433 1NV8 MEQ 0.00003544 0.52156 8.4507
434 3A27 SAM 0.00001437 0.52154 8.45588
435 4OBW SAM 0.00001786 0.5043 8.56031
436 1LSS NAD 0.0001671 0.47931 8.57143
437 3HVJ 705 0.00006206 0.52446 8.59729
438 2B4R AES 0.01624 0.40227 8.69565
439 3JWH SAH 0.00000005059 0.59114 8.75576
440 1G60 SAM 0.0001005 0.48686 8.84615
441 1N2X SAM 0.0001267 0.44107 8.9701
442 3VC1 SAH 0.00001346 0.56008 8.97436
443 3VC1 GST 0.00001346 0.56008 8.97436
444 3FZG SAM 0.000009165 0.51948 9
445 1QAN SAH 0.0000298 0.51482 9.01639
446 1FP1 SAH 0.006311 0.42951 9.13978
447 2XYQ SAH 0.003058 0.41941 9.31034
448 3GD4 FAD 0.003222 0.46039 9.60591
449 3GD4 NAD 0.00489 0.46039 9.60591
450 4USR FAD 0.01536 0.40692 9.69529
451 2ZFU SAH 0.000000988 0.5782 9.76744
452 2HQM FAD 0.001245 0.46838 9.85222
453 4BV6 FAD 0.003729 0.44451 9.85222
454 1QO8 FAD 0.0126 0.42002 9.85222
455 5GWX SAR 0.0001195 0.49566 9.85915
456 5GWX SAM 0.0001195 0.49566 9.85915
457 1P72 ADP 0.01816 0.40121 9.88024
458 5FTW SAH 0.0006564 0.42703 10.1562
459 1I1N SAH 0.00001834 0.53464 10.177
460 1UWK URO 0.0009649 0.47673 10.3448
461 1UWK NAD 0.0009649 0.47673 10.3448
462 5JE0 SAH 0.000003358 0.57417 10.5263
463 5JE0 AZ8 0.000003358 0.57417 10.5263
464 2WSB NAD 0.02262 0.40596 10.6299
465 2XVM SAH 0.000007215 0.51617 11.0553
466 4QTU SAM 0.0000002814 0.56748 11.0577
467 1I9G SAM 0.0000335 0.51028 11.0714
468 1DMR PGD 0.01977 0.42606 11.0837
469 3GJ7 GDP 0.009469 0.40697 11.2245
470 4YSX FAD 0.02766 0.40262 11.5385
471 4CNK FAD 0.01701 0.41003 11.7647
472 1R18 SAH 0.006993 0.43677 11.8943
473 3DXY SAM 0.0000008481 0.59618 11.9266
474 1XSE NDP 0.01756 0.41126 12.2034
475 5T67 JHZ 0.00001391 0.5658 12.5616
476 5T67 SAH 0.00001187 0.56269 12.5616
477 3OFK SAH 0.0001051 0.45005 13.4259
478 4YMH SAH 0.000007808 0.53835 14.1667
479 4TM3 FAD 0.01358 0.43493 14.2857
480 3Q87 SAM 0.002202 0.43317 15.2
481 4II2 ATP 0.0003375 0.46576 15.6627
482 4J56 FAD 0.006727 0.43499 15.7895
483 2JJQ SAH 0.0006374 0.43656 16.2562
484 1ZMD FAD 0.001564 0.46463 16.9951
485 2F5Z FAD 0.002083 0.45863 16.9951
486 1ZMD NAI 0.003381 0.42803 16.9951
487 3BXO SAM 0.0000003443 0.56928 17.1548
488 3RNM FAD 0.002887 0.45181 17.734
489 3PFG SAM 0.01777 0.43718 22.0532
490 3PFG TLO 0.01777 0.43718 22.0532
Pocket No.: 2; Query (leader) PDB : 5X62; Ligand: SAH; 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: 5x62.bio1) has 20 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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