Receptor
PDB id Resolution Class Description Source Keywords
2EG5 2.2 Å EC: 2.1.1.- THE STRUCTURE OF XANTHOSINE METHYLTRANSFERASE COFFEA CANEPHORA SAM-DEPENDANT N-METHYLTRANSFERASE XANTHOSINE SAH TRANSFER
Ref.: THE STRUCTURE OF TWO N-METHYLTRANSFERASES FROM THE BIOSYNTHETIC PATHWAY PLANT PHYSIOL. V. 144 879 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
SAH A:501;
C:1501;
E:2501;
G:3501;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
384.411 C14 H20 N6 O5 S c1nc(...
XTS A:502;
C:1502;
E:2502;
G:3502;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
284.225 C10 H12 N4 O6 c1nc2...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2EG5 2.2 Å EC: 2.1.1.- THE STRUCTURE OF XANTHOSINE METHYLTRANSFERASE COFFEA CANEPHORA SAM-DEPENDANT N-METHYLTRANSFERASE XANTHOSINE SAH TRANSFER
Ref.: THE STRUCTURE OF TWO N-METHYLTRANSFERASES FROM THE BIOSYNTHETIC PATHWAY PLANT PHYSIOL. V. 144 879 2007
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 57 families.
1 2EG5 - XTS C10 H12 N4 O6 c1nc2c(n1[....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 50 families.
1 2EG5 - XTS C10 H12 N4 O6 c1nc2c(n1[....
2 2EFJ - SAH C14 H20 N6 O5 S c1nc(c2c(n....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 44 families.
1 2EG5 - XTS C10 H12 N4 O6 c1nc2c(n1[....
2 2EFJ - 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
Ligand no: 2; Ligand: XTS; Similar ligands found: 7
No: Ligand ECFP6 Tc MDL keys Tc
1 XTS 1 1
2 13A 0.565217 0.810127
3 GMP 0.472973 0.913043
4 NOS 0.445946 0.910448
5 MZR 0.42029 0.835821
6 93A 0.416667 0.768293
7 6CG 0.411765 0.782051
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2EG5; Ligand: XTS; Similar sites found: 16
This union binding pocket(no: 1) in the query (biounit: 2eg5.bio1) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5HSA FAS 0.03386 0.40767 2.15054
2 5JE0 AZ8 0.02908 0.40228 2.42915
3 5JE0 SAH 0.02908 0.40228 2.42915
4 2OVD DAO 0.01358 0.40869 2.74725
5 5A8E XTK 0.01654 0.40405 3.49206
6 3BQD DAY 0.008013 0.41593 3.92157
7 4I9B 1KA 0.008947 0.40895 4.30108
8 1J78 OLA 0.01267 0.40349 4.30108
9 5IXK 6EW 0.01239 0.40517 4.82456
10 4ZOM 4Q3 0.02094 0.41471 4.88889
11 5HK9 64O 0.005307 0.42075 5.64784
12 1Y9Q MED 0.004083 0.43737 5.72917
13 3KFC 61X 0.00868 0.42608 9.09091
14 4OIV XX9 0.02513 0.41163 15.0442
15 5F2K OCA 0.005225 0.43952 38.8587
16 5F2K SAH 0.005225 0.43952 38.8587
Pocket No.: 2; Query (leader) PDB : 2EG5; Ligand: SAH; Similar sites found: 537
This union binding pocket(no: 2) in the query (biounit: 2eg5.bio1) has 18 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1YY5 FAD 0.01066 0.43238 1.07527
2 4V3C C 0.006663 0.408 1.07527
3 5N5D SAM 0.0001635 0.4883 1.32743
4 3VSE SAH 0.00006811 0.48751 1.34409
5 5TTJ FAD 0.0082 0.43444 1.34409
6 4FWE FAD 0.01069 0.43144 1.34409
7 1KNR FAD 0.02105 0.41393 1.34409
8 1KOL NAD 0.03327 0.40019 1.34409
9 2PXX SAH 0.000002997 0.56848 1.39535
10 1UDB NAD 0.006248 0.44914 1.47929
11 2WSB NAD 0.01614 0.41973 1.5748
12 4KRG SAH 0.0000003363 0.60613 1.6129
13 1FP1 SAH 0.000001946 0.56825 1.6129
14 3QOX SAH 0.00008484 0.50799 1.6129
15 1BZL FAD 0.002548 0.49231 1.6129
16 2Z3Y F2N 0.002099 0.46699 1.6129
17 1REO FAD 0.001833 0.4658 1.6129
18 1SQF SAM 0.0007479 0.45568 1.6129
19 4AP3 FAD 0.01368 0.43731 1.6129
20 4AP3 NAP 0.01368 0.43731 1.6129
21 3NT6 FAD 0.0124 0.42352 1.6129
22 4X9M FAD 0.02896 0.40695 1.6129
23 2WET FAD 0.033 0.40581 1.6129
24 2JAH NDP 0.01337 0.41429 1.61943
25 3P9C SAH 0.00001582 0.55755 1.64835
26 1H2B NAJ 0.02423 0.40393 1.67131
27 3TKA SAM 0.0006181 0.46368 1.72911
28 4ZCC FAD 0.009856 0.43901 1.78571
29 4ZCC NAI 0.009856 0.43901 1.78571
30 5MW4 5JU 0.0002787 0.50759 1.79641
31 3CMC NAD 0.02019 0.4315 1.79641
32 5KVA SAM 0.0002343 0.48531 1.79856
33 3AYI FAD 0.003533 0.46261 1.88172
34 3AYI HCI 0.003662 0.46261 1.88172
35 4C3Y FAD 0.004812 0.44698 1.88172
36 1V5F FAD 0.009908 0.44655 1.88172
37 4C3Y ANB 0.007419 0.44206 1.88172
38 2Y6Q I7T 0.01892 0.42139 1.88172
39 4EIP K2C 0.01933 0.42092 1.88172
40 4EIP FAD 0.01933 0.42092 1.88172
41 2Y6Q FAD 0.01186 0.41801 1.88172
42 3G5S FAD 0.01647 0.4164 1.88172
43 1DJN ADP 0.008584 0.41386 1.88172
44 5MZI FYK 0.04079 0.41239 1.88172
45 5MZI FAD 0.03972 0.41239 1.88172
46 4R84 CSF 0.007777 0.40495 1.88172
47 2FNU PMP UD1 0.02679 0.40489 1.88172
48 4ZUL UN1 0.03564 0.4015 1.88172
49 1I8T FAD 0.002436 0.45967 1.90736
50 1X1T NAD 0.01958 0.40848 1.92308
51 1Q0S SAH 0.0000464 0.52234 1.9305
52 5K8V 6RE 0.000201 0.52814 1.93906
53 1PL6 572 0.01111 0.41939 1.96629
54 1PL6 NAD 0.005823 0.41841 1.96629
55 4A6D SAM 0.0000007573 0.59606 1.983
56 1ZK4 NAP 0.005478 0.439 1.99203
57 5DX1 SFG 0.00004077 0.52699 2.00573
58 5DX8 SFG 0.00004142 0.52259 2.00573
59 5DXA SFG 0.00004354 0.44585 2.00573
60 3B20 NAD 0.01921 0.40024 2.0649
61 5JGL SAM 0.00001584 0.52982 2.07612
62 3C3Y SAH 0.001672 0.44167 2.1097
63 5MPT SAH 0.00001465 0.53408 2.15054
64 3NJ4 AFX 0.004277 0.48701 2.15054
65 3HDY GDU 0.001751 0.48517 2.15054
66 3HDY FDA 0.001696 0.48517 2.15054
67 3HDY FAD 0.002236 0.47893 2.15054
68 5HSA FAS 0.001268 0.47592 2.15054
69 3NJ4 NAD 0.008041 0.47186 2.15054
70 2RAB NAD 0.003817 0.46954 2.15054
71 2RAB FAD 0.001953 0.46954 2.15054
72 2CDU FAD 0.002647 0.45456 2.15054
73 1ELI PYC 0.003936 0.44826 2.15054
74 4CNK FAD 0.009257 0.42984 2.15054
75 3E1T FAD 0.01226 0.42844 2.15054
76 5EOW FAD 0.01157 0.42081 2.15054
77 3GMB FAD 0.01313 0.41812 2.15054
78 2CDU ADP 0.009244 0.40356 2.15054
79 2CUL FAD 0.002504 0.45458 2.15517
80 1XHC FAD 0.006347 0.43585 2.17984
81 5JY6 NAD 0.02944 0.41383 2.24719
82 5GT9 NAP 0.01032 0.41974 2.28137
83 3LST SAH 0.000004223 0.54983 2.29885
84 1V59 FAD 0.003676 0.45662 2.30126
85 1V59 NAD 0.00681 0.40165 2.30126
86 2O07 SPD 0.0009926 0.46756 2.30263
87 2O07 MTA 0.0008589 0.46756 2.30263
88 1NFQ NAI 0.02252 0.40439 2.30769
89 3A25 SAM 0.0006683 0.45792 2.32558
90 3KLJ FAD 0.001975 0.45716 2.33766
91 2ZIF SAM 0.0005685 0.46331 2.3569
92 1XSE NDP 0.01028 0.42954 2.37288
93 5X62 SAH 0.0000009375 0.58583 2.41935
94 5M67 NAD 0.001731 0.47588 2.41935
95 5M67 ADE 0.00184 0.47454 2.41935
96 5M67 3D1 0.002149 0.47111 2.41935
97 3SQP FAD 0.01753 0.4635 2.41935
98 4HXY NDP 0.002674 0.44817 2.41935
99 3LXD FAD 0.003726 0.44611 2.41935
100 1X87 NAD 0.002175 0.44189 2.41935
101 2YVF NAD 0.01384 0.43768 2.41935
102 2YVF FAD 0.01345 0.43768 2.41935
103 5MBX FAD 0.01339 0.43438 2.41935
104 5MBX SP5 0.01339 0.43438 2.41935
105 2YVJ FAD 0.00799 0.43198 2.41935
106 2Q1S NAI 0.01282 0.42746 2.41935
107 1UP7 NAD 0.01595 0.40409 2.41935
108 1E5Q NDP 0.01931 0.40408 2.41935
109 5JE0 SAH 0.000001682 0.60289 2.42915
110 5JE0 AZ8 0.000001682 0.60289 2.42915
111 3H2B SAH 0.00001493 0.53628 2.46305
112 1OMO NAD 0.01551 0.40324 2.48447
113 2A92 NAI 0.0274 0.4002 2.49221
114 3CIF G3H 0.02696 0.40165 2.50696
115 3CIF NAD 0.02032 0.40043 2.50696
116 3T31 DCQ 0.02467 0.42198 2.51716
117 3T31 FAD 0.02324 0.42198 2.51716
118 1ZGA SAH 0.000006627 0.54103 2.52101
119 3EVF GTA 0.00003353 0.55202 2.52708
120 3EVF SAH 0.00002758 0.55202 2.52708
121 2BZG SAH 0.00005147 0.50903 2.58621
122 3G2O SAM 0.0000005025 0.55044 2.67559
123 4NTC FAD 0.00764 0.43693 2.68657
124 4AZT SAM 0.0000001881 0.62089 2.68817
125 4AZW SAM 0.0000003441 0.61187 2.68817
126 3L9W AMP 0.000152 0.50838 2.68817
127 3L9W GSH 0.0004006 0.48498 2.68817
128 4Z24 FAD 0.003938 0.45231 2.68817
129 5KMS FAD 0.003029 0.45168 2.68817
130 4DCM SAM 0.0007673 0.4506 2.68817
131 5JCM NAD 0.01113 0.44453 2.68817
132 5JCM FAD 0.01083 0.44453 2.68817
133 5JCM ISD 0.01113 0.44453 2.68817
134 4BJZ P3A 0.0193 0.43482 2.68817
135 3CGB FAD 0.0113 0.42452 2.68817
136 1Q9I TEO 0.02251 0.42404 2.68817
137 4E70 N7I 0.00002286 0.41374 2.68817
138 5KMS NAD 0.04817 0.40735 2.68817
139 2IV2 MGD 0.0303 0.40222 2.68817
140 3BGD PM6 0.00005145 0.52595 2.69231
141 3BGD SAH 0.00003514 0.52594 2.69231
142 3HVJ 705 0.0001116 0.52352 2.71493
143 5DRB 5FJ 0.02997 0.40877 2.74914
144 4XUC 43G 0.0000979 0.52216 2.75229
145 4XUC SAM 0.0000979 0.52216 2.75229
146 1L1E SAH 0.00003321 0.52263 2.78746
147 5UAV TFB 0.02914 0.40307 2.79503
148 5UAV NDP 0.02914 0.40307 2.79503
149 1M2K APR 0.008633 0.41962 2.81124
150 1EDO NAP 0.004017 0.44089 2.86885
151 1ORR NAD 0.003537 0.44483 2.88184
152 1R37 NAD 0.02517 0.40418 2.88184
153 1XDS SAM 0.000003936 0.55121 2.95699
154 1UWK URO 0.0003796 0.50637 2.95699
155 1UWK NAD 0.0003796 0.50637 2.95699
156 4YNU FAD 0.002094 0.46801 2.95699
157 4YNU LGC 0.002473 0.46801 2.95699
158 3GD4 NAD 0.007718 0.45763 2.95699
159 3GD4 FAD 0.005231 0.45763 2.95699
160 3C6K SPD 0.00346 0.44883 2.95699
161 3C6K MTA 0.00346 0.44883 2.95699
162 3EYA FAD 0.005647 0.43724 2.95699
163 1E1M FAD 0.01276 0.43474 2.95699
164 2XVE FAD 0.01975 0.42897 2.95699
165 2XVF FAD 0.01149 0.42415 2.95699
166 5J7X FAD 0.01286 0.42274 2.95699
167 3V1U NAD 0.008267 0.41769 2.95699
168 4YUW S4M 0.01701 0.44917 2.96053
169 4YUW 4JU 0.01731 0.44917 2.96053
170 5BW4 SAM 0.00001014 0.53867 2.99625
171 3FZG SAM 0.0001062 0.47765 3
172 2V6G NAP 0.005915 0.43148 3.02198
173 2DTX BMA 0.003167 0.45401 3.0303
174 5LD5 NAD 0.01035 0.41003 3.07263
175 2AE2 NAP 0.03782 0.40108 3.07692
176 2AE2 PTO 0.03782 0.40108 3.07692
177 1BXK NAD 0.00586 0.42906 3.09859
178 3OID NDP 0.004915 0.43786 3.10078
179 2CIG 1DG 0.03933 0.40192 3.14465
180 3CH6 NAP 0.01332 0.43855 3.14685
181 3CH6 311 0.01332 0.43855 3.14685
182 2Q46 NAP 0.004031 0.43687 3.16206
183 4D42 NAP 0.02801 0.41495 3.19149
184 4D42 W0I 0.02801 0.41495 3.19149
185 3OU2 SAH 0.00003831 0.43273 3.21101
186 3JWH SAH 0.000001273 0.56376 3.22581
187 1QZZ SAM 0.0000264 0.51401 3.22581
188 5JAQ NAI 0.0007475 0.48514 3.22581
189 4EMI NAD 0.006733 0.45334 3.22581
190 4EMI FAD 0.003109 0.45334 3.22581
191 3UCL CYH 0.01282 0.4413 3.22581
192 3UCL NAP 0.01386 0.4413 3.22581
193 3UCL FAD 0.01282 0.4413 3.22581
194 2C31 ADP 0.02079 0.4331 3.22581
195 2C31 TZD 0.02129 0.4331 3.22581
196 3OJO NAD 0.01025 0.41024 3.22581
197 1SC6 NAD 0.02176 0.40512 3.22581
198 4XYM COA 0.02811 0.40848 3.23276
199 4XZ3 COA 0.01643 0.40056 3.23276
200 1R6D NAD 0.009695 0.44089 3.2641
201 1R6D DAU 0.009375 0.44089 3.2641
202 3RIY NAD 0.00673 0.42748 3.2967
203 2NYR SVR 0.02586 0.43263 3.32103
204 1GAD NAD 0.01524 0.40642 3.33333
205 4KIB SAH 0.000006581 0.54722 3.36134
206 2Q7V FAD 0.008597 0.43436 3.38462
207 5J60 FAD 0.02752 0.40806 3.4375
208 1KPH SAH 0.00007208 0.5092 3.48432
209 1KPG SAH 0.00005918 0.44946 3.48432
210 4R6W SAH 0.00003021 0.54393 3.48837
211 4R6W PC 0.00009343 0.5433 3.48837
212 3OND ADN 0.001689 0.47552 3.49462
213 4RSL FAD 0.001357 0.46884 3.49462
214 5U8U FAD 0.004752 0.4639 3.49462
215 4DSG UDP 0.009444 0.44569 3.49462
216 4DSG FAD 0.009444 0.44569 3.49462
217 4MOP 2H5 0.01367 0.43247 3.49462
218 1Y8Q ATP 0.0004461 0.40646 3.49462
219 1S7G APR 0.006101 0.43328 3.55731
220 1S7G NAD 0.005591 0.43266 3.55731
221 4GKV NAD 0.01548 0.4146 3.57143
222 2QQF A1R 0.01358 0.40742 3.57143
223 2OD9 A1R NCA 0.02003 0.40455 3.57143
224 1JA9 NDP 0.007181 0.42862 3.64964
225 3QV1 NAD 0.004162 0.43184 3.65854
226 1AE1 NAP 0.02675 0.40181 3.663
227 3A27 SAM 0.0004516 0.43573 3.67647
228 1OC2 TDX 0.01724 0.42939 3.73563
229 1OC2 NAD 0.01724 0.42939 3.73563
230 1IY8 NAD 0.008986 0.42267 3.74532
231 2WPF FAD 0.001993 0.49759 3.76344
232 2WPF WPF 0.004192 0.48151 3.76344
233 3PT9 SAH 0.000243 0.4781 3.76344
234 1I2B NAD 0.003577 0.46392 3.76344
235 1GET NAP 0.0084 0.45279 3.76344
236 1GET FAD 0.007963 0.45279 3.76344
237 4M52 FAD 0.004032 0.4518 3.76344
238 2C7G FAD 0.01612 0.43091 3.76344
239 2C7G ODP 0.01563 0.43091 3.76344
240 4AT0 FAD 0.03278 0.40994 3.76344
241 3IHG FAD 0.01463 0.40992 3.76344
242 4K5S FAD 0.02155 0.40644 3.76344
243 4K5S PM0 0.03959 0.40644 3.76344
244 5MGZ SAH 0.0000005104 0.60397 3.81356
245 1TPY SAH 0.00006991 0.50982 3.83275
246 4ZRN NAD 0.002879 0.45041 3.84615
247 4ZRN UPG 0.005822 0.44909 3.84615
248 3L4S NAD 0.005534 0.43413 3.86905
249 3L4S 3PG 0.00586 0.43413 3.86905
250 4OBW SAM 0.000009378 0.50101 3.89105
251 1BXG NAD 0.01918 0.40163 3.93258
252 5HJM MTA 0.00003114 0.47109 3.97727
253 1FEC FAD 0.0008201 0.49047 4.03226
254 3LAD FAD 0.002799 0.45974 4.03226
255 4GUT FAD 0.009764 0.43601 4.03226
256 4GUS FAD 0.01073 0.43224 4.03226
257 4D7E FAD 0.007679 0.43177 4.03226
258 1SAY PYR 0.02812 0.4018 4.03226
259 3GEG NAD 0.0003354 0.48706 4.04858
260 3NUG NAD 0.0233 0.40252 4.04858
261 2VDV SAM 0.000004135 0.55025 4.06504
262 1LTH NAD 0.01209 0.4126 4.07523
263 1BC5 SAH 0.0001742 0.49333 4.08922
264 2BD0 NAP 0.01271 0.41654 4.09836
265 1DL5 SAH 0.0004405 0.47976 4.10095
266 1KYZ FER 0.00002308 0.54258 4.10959
267 1KYZ SAH 0.000009654 0.54239 4.10959
268 3Q87 SAM 0.002453 0.43943 4.11765
269 3WV8 ATP 0.005678 0.41712 4.12844
270 4RDI ATP 0.002263 0.4336 4.16667
271 4RDH AMP 0.006242 0.40171 4.16667
272 2ZFU SAH 0.00000196 0.57969 4.18605
273 5JCA FAD 0.02258 0.41417 4.22535
274 5JCA NDP 0.04136 0.41267 4.22535
275 2P41 SAH 0.00001015 0.5414 4.2623
276 1U2Z SAH 0.0000445 0.52113 4.30108
277 4N49 SAM 0.0001013 0.50014 4.30108
278 4DMG SAM 0.0002333 0.47709 4.30108
279 3CTY FAD 0.008518 0.4373 4.30108
280 3O03 NAP 0.004263 0.43285 4.30108
281 1G55 SAH 0.0000195 0.47505 4.37318
282 1NW5 SAM 0.00319 0.4287 4.38871
283 3U31 NAD 0.001976 0.44208 4.48276
284 5E8J SAH 0.0000001587 0.61397 4.48718
285 5E9W SAH 0.0000001273 0.60678 4.48718
286 1FL2 FAD 0.003923 0.44939 4.51613
287 1SB8 NAD 0.01136 0.43349 4.54545
288 1SB8 UD2 0.01306 0.43349 4.54545
289 3PFG TLO 0.000001302 0.62352 4.56274
290 3PFG SAM 0.002932 0.48602 4.56274
291 5T67 SAH 0.000254 0.50959 4.56989
292 5T67 JHZ 0.000341 0.50871 4.56989
293 3GDN FAD 0.001829 0.469 4.56989
294 3GDN HBX 0.002555 0.469 4.56989
295 1PN0 IPH 0.002681 0.46622 4.56989
296 1PN0 FAD 0.002577 0.46622 4.56989
297 5EB4 FAD 0.005124 0.44463 4.56989
298 1U1I NAD 0.005106 0.43824 4.56989
299 2RGJ FAD 0.009956 0.42289 4.56989
300 1MV8 NAD 0.02042 0.40033 4.56989
301 3MQ2 SAH 0.0001535 0.48483 4.58716
302 5A3B APR 0.007285 0.42175 4.62046
303 4JK3 NAD 0.005289 0.42838 4.6332
304 4J4H 1J1 0.01628 0.42472 4.6332
305 4J4H NAI 0.01628 0.42472 4.6332
306 1OAA OAA 0.04109 0.40177 4.6332
307 4PNE SAH 0.000001598 0.58889 4.63576
308 4D79 ATP 0.002135 0.43476 4.71014
309 3EVG SAH 0.000007908 0.54637 4.72727
310 4ZA2 NAD 0.007567 0.42372 4.74308
311 5LW0 AR6 0.008048 0.41674 4.7619
312 2OFW ADX 0.03211 0.40193 4.80769
313 5G3U FDA 0.004096 0.4474 4.83871
314 4XQC NAD 0.01347 0.42637 4.83871
315 1MO9 FAD 0.03749 0.42293 4.83871
316 4XQC 13D 0.02073 0.41774 4.83871
317 2FZW NAD 0.02497 0.4128 4.83871
318 1R18 SAH 0.00001103 0.54725 4.84582
319 5D4V SAH 0.004699 0.4245 4.85075
320 2HMT NAI 0.000184 0.4902 4.86111
321 1EK6 NAI 0.0304 0.41523 4.88506
322 5K7U SAM 0.005774 0.41489 4.88889
323 1PR9 NAP 0.02305 0.405 4.91803
324 3D3W NAP 0.02706 0.40157 4.91803
325 4POO SAM 0.002647 0.43955 5
326 2XVM SAH 0.0000008147 0.582 5.02513
327 2WA2 SAM 0.00003958 0.51168 5.07246
328 5JJR SAH 0.00001229 0.49492 5.10753
329 1YBH FAD 0.001259 0.4739 5.10753
330 4HA6 FAD 0.003224 0.45763 5.10753
331 4D04 FAD 0.01044 0.44472 5.10753
332 4D04 NAP 0.01044 0.44472 5.10753
333 1QO8 FAD 0.01085 0.43022 5.10753
334 5UAO FAD 0.01283 0.42278 5.10753
335 4TM3 FAD 0.03712 0.41858 5.10753
336 5LOG SAH 0.00008089 0.50241 5.15021
337 2UYQ SAM 0.00004091 0.44462 5.16129
338 3RNM FAD 0.007731 0.43853 5.17241
339 4BLW SAH 0.0003686 0.48344 5.19031
340 4BLW AMP 0.002136 0.45675 5.19031
341 1ZBQ NAD 0.002191 0.45368 5.19878
342 3AY6 BGC 0.04291 0.40535 5.20446
343 3AY6 NAI 0.0328 0.40147 5.20446
344 4PIO SAH 0.000009943 0.57066 5.26316
345 4PIO AVI 0.000009742 0.56946 5.26316
346 4TQG NDP 0.0007149 0.47292 5.26316
347 1QAN SAH 0.0003823 0.47539 5.32787
348 2YX1 SFG 0.0002332 0.47142 5.35714
349 4RPL 3UC 0.001589 0.49016 5.37634
350 4RPL FAD 0.002362 0.4791 5.37634
351 2NVK FAD 0.002438 0.46174 5.37634
352 5BVA FAD 0.003154 0.45905 5.37634
353 3Q9T FAY 0.0128 0.42283 5.37634
354 5GM1 SAH 0.000001704 0.58758 5.38721
355 3ZG6 APR 0.004056 0.42572 5.40541
356 3TKY SAH 0.000001403 0.5837 5.43478
357 4NBW NAD 0.01129 0.41403 5.44747
358 1E6E FAD 0.006498 0.43535 5.46875
359 2AOT SAH 0.000002054 0.56719 5.47945
360 1JQD HSM 0.000012 0.43813 5.47945
361 1JQD SAH 0.000006706 0.43096 5.47945
362 4J36 FAD 0.008038 0.42743 5.54217
363 3T7S SAM 0.000001381 0.58115 5.59701
364 3LKZ SFG 0.00000898 0.54647 5.60748
365 2GDZ NAD 0.01866 0.40604 5.61798
366 4KRI SAH 0.000001813 0.58125 5.64516
367 4TXI FAD 0.003055 0.44667 5.64516
368 2BRY FAD 0.004428 0.44007 5.64516
369 2YG3 FAD 0.009475 0.4313 5.64516
370 1FP2 SAH 0.0002711 0.50191 5.68182
371 1O97 FAD 0.002243 0.47513 5.68182
372 1O97 AMP 0.002243 0.47513 5.68182
373 1O94 ADP 0.008174 0.41642 5.68182
374 3FPF MTA 0.00013 0.52283 5.7047
375 3FPF TNA 0.00013 0.52283 5.7047
376 1DSS NAD 0.01915 0.4003 5.70571
377 1J0X NAD 0.03248 0.40699 5.72289
378 1VE3 SAM 0.00001039 0.54093 5.72687
379 4CQM NAP 0.02169 0.40286 5.74713
380 3P2E SAH 0.0001958 0.48686 5.77778
381 1UXG NAD 0.03395 0.40166 5.82524
382 4X7Y SAH 0.003842 0.45187 5.83942
383 3ICS FAD 0.009472 0.42934 5.91398
384 2DKH 3HB 0.01015 0.42885 5.91398
385 2DKH FAD 0.007519 0.42885 5.91398
386 3ICT FAD 0.01117 0.42476 5.91398
387 3ICR FAD 0.0113 0.42452 5.91398
388 2PT9 2MH 0.003999 0.44343 5.919
389 2PT9 S4M 0.002604 0.4415 5.919
390 3GWZ SAH 0.000009997 0.53299 5.96206
391 3GXO SAH 0.00003814 0.49718 5.96206
392 2DPM SAM 0.00004731 0.51774 5.98592
393 2EWM NAD 0.003094 0.44511 6.0241
394 1U7T TDT 0.00216 0.46436 6.13027
395 1U7T NAD 0.02024 0.40183 6.13027
396 5KOK SAH 0.0000004021 0.60874 6.1828
397 5KOK S9T 0.000009649 0.5713 6.1828
398 5KOK R9T 0.000008929 0.5713 6.1828
399 4GQB 0XU 0.00002296 0.53674 6.1828
400 5FA5 MTA 0.0001128 0.48834 6.1828
401 1GY8 NAD 0.0008372 0.47256 6.1828
402 2GV8 FAD 0.01572 0.41427 6.1828
403 1VQW FAD 0.01576 0.41311 6.1828
404 2GVC FAD 0.01854 0.40965 6.1828
405 4YAG NAI 0.01677 0.42069 6.22837
406 1Z3C SA8 0.000001642 0.60146 6.37584
407 3GCZ SAM 0.000003317 0.56368 6.38298
408 1WVG APR 0.008619 0.41682 6.40669
409 1I9G SAM 0.0008988 0.45613 6.42857
410 2EJU SAH 0.00007955 0.50035 6.45161
411 2HQM FAD 0.002709 0.46045 6.45161
412 4BV6 FAD 0.005105 0.44569 6.45161
413 1RSG FAD 0.00559 0.44468 6.45161
414 1V8B NAD 0.004207 0.44465 6.45161
415 4MIG G3F 0.007807 0.4426 6.45161
416 1P1C SAH 0.0001961 0.49092 6.53266
417 5DNK SAH 0.00001777 0.50697 6.72043
418 4UCI SAM 0.0002013 0.48412 6.72043
419 2V3A FAD 0.01791 0.41556 6.72043
420 1L3I SAH 0.00005149 0.5241 6.77083
421 4YRY FAD 0.01562 0.42225 6.88406
422 4YRY NAD 0.03457 0.40799 6.88406
423 1NM5 NAD 0.02543 0.41855 6.89655
424 1NM5 NAP 0.02617 0.4172 6.89655
425 5O4J SAH 0.007237 0.43082 6.93431
426 5O4J 9KH 0.007237 0.43082 6.93431
427 5O4J PJL 0.01152 0.41979 6.93431
428 5E72 SAM 0.0003113 0.47955 6.93642
429 5THY SAH 0.00001514 0.53846 6.98925
430 4EUE NAI 0.0005083 0.48447 6.98925
431 2VVM FAD 0.007005 0.43785 6.98925
432 1D4D FAD 0.01507 0.42391 6.98925
433 1PS9 FAD 0.03313 0.40487 6.98925
434 2WOX NDP 0.02891 0.40121 6.98925
435 5GWX SAR 0.0008671 0.46577 7.04225
436 5GWX SAM 0.0008671 0.46577 7.04225
437 2PX8 SAH 0.00004883 0.51008 7.0632
438 1G0N NDP 0.0185 0.41486 7.06714
439 1G0N PHH 0.02368 0.41225 7.06714
440 1XHL NDP 0.004064 0.44065 7.07071
441 1GR0 NAD 0.02062 0.40846 7.08447
442 3RJ5 NAD 0.01906 0.41422 7.08661
443 2HNK SAH 0.0002684 0.4805 7.11297
444 5CUQ NSC 0.00002544 0.54755 7.11611
445 1XKQ NDP 0.004969 0.43763 7.14286
446 3H8V ATP 0.002642 0.43051 7.19178
447 4USQ FAD 0.01575 0.41424 7.20222
448 3QVP FAD 0.002368 0.46436 7.25806
449 2Q28 ADP 0.002845 0.431 7.25806
450 5BUK FAD 0.01353 0.42714 7.25806
451 2X3N FAD 0.004752 0.44314 7.26817
452 5ULP KB1 0.000006304 0.5632 7.46269
453 5E1M PRO PRO LYS ARG ILE ALA 0.000001097 0.61742 7.46888
454 5E1M SAH 0.000001097 0.61742 7.46888
455 4EMJ FAD 0.00303 0.45496 7.47664
456 1XTP SAI 0.0000001736 0.62248 7.48031
457 2JHP SAH 0.00106 0.44654 7.52688
458 2BGM NAJ 0.01383 0.40845 7.55396
459 4BUZ NAD 0.006948 0.42414 7.72358
460 4BUZ OCZ 0.00838 0.42414 7.72358
461 4BUZ OAD 0.00838 0.42414 7.72358
462 1YC5 NCA 0.009396 0.41785 7.72358
463 5XVK SAH 0.00006015 0.51499 7.74648
464 3QWI CUE 0.01416 0.4235 7.77778
465 3QWI NAP 0.009152 0.4235 7.77778
466 1PNO NAP 0.008448 0.42271 7.77778
467 5THZ SAH 0.00002573 0.53229 7.7957
468 3U4C NDP 0.0002358 0.49602 7.82918
469 4JNA FAD 0.00345 0.45519 7.94118
470 3BXO SAM 0.000000354 0.59829 7.94979
471 2OOR TXP 0.009213 0.41826 8.04598
472 5XVQ SAH 0.00008966 0.43426 8.09859
473 5ITV NAI 0.008569 0.42367 8.23529
474 5F8F SFG 0.00002699 0.5165 8.33333
475 1ZEM NAD 0.004278 0.43278 8.39695
476 1I1N SAH 0.0000846 0.51564 8.40708
477 1KYQ NAD 0.009307 0.40342 8.75912
478 2PWY SAH 0.00004882 0.51924 8.91473
479 3AD8 PYC 0.01066 0.44612 9.13978
480 3AD8 FAD 0.01066 0.44612 9.13978
481 5FA8 SAM 0.000007802 0.55659 9.31677
482 3ELW SAM 0.0000349 0.55376 9.33333
483 3ELW GP3 0.00003698 0.55376 9.33333
484 2PZM NAD 0.005443 0.4462 9.39394
485 2PZM UDP 0.005443 0.4462 9.39394
486 3VYW SAM 0.0002167 0.43564 9.41558
487 1G60 SAM 0.002147 0.43666 9.61539
488 4NEC SAH 0.000006779 0.52779 10.2273
489 1F3L SAH 0.00001749 0.5379 10.2804
490 4K26 SFF 0.01206 0.4251 10.5072
491 4K26 NDP 0.009316 0.42191 10.5072
492 3DXY SAM 0.00009509 0.48182 10.5505
493 1UAY ADN 0.000286 0.46743 10.7438
494 4MO2 FDA 0.001968 0.46205 10.8696
495 4REP FAD 0.00216 0.46226 11.0215
496 4NTD FAD 0.006761 0.43661 11.1765
497 1JNR FAD 0.00999 0.45168 11.5591
498 3UOY FAD 0.04168 0.41534 11.5591
499 3UOY NAP 0.04168 0.41534 11.5591
500 5XLX SAH 0.00008643 0.4987 11.7021
501 1NJR XYL 0.006776 0.42466 12.3239
502 3S5W FAD 0.007939 0.42528 12.3656
503 2YY7 NAD 0.01808 0.4079 12.5
504 5BR7 FAD 0.001343 0.49044 12.6344
505 5BR7 FLC 0.001624 0.48615 12.6344
506 1RP0 AHZ 0.01022 0.42115 12.6761
507 4LWP SAH 0.00006159 0.50545 12.7717
508 1LSS NAD 0.00003107 0.52397 12.8571
509 1JG3 ADN 0.0002289 0.44598 13.1915
510 2A14 SAH 0.000126 0.49788 13.308
511 3ZV6 4HB 0.005838 0.44373 13.5231
512 3ZV6 NAD 0.005587 0.44373 13.5231
513 4YMH SAH 0.00003999 0.51889 13.75
514 1DJL NAP 0.006034 0.43351 14.9758
515 2OBF F83 0.0003123 0.50741 15.2249
516 2OBF SAH 0.0003123 0.50741 15.2249
517 5FTW SAH 0.000002747 0.57288 15.625
518 3SJ7 NDP 0.02197 0.40137 15.873
519 4II2 ATP 0.0004245 0.47126 15.9509
520 1D4O NAP 0.008203 0.41929 16.8478
521 3LZW FAD 0.01266 0.42308 17.1687
522 3LZW NAP 0.02698 0.42059 17.1687
523 5L95 AMP 0.0005699 0.46326 17.5
524 3MB5 SAM 0.00002324 0.53436 17.6471
525 2V3B FAD 0.02008 0.41211 18.1818
526 4HSU FAD 0.009529 0.43484 20
527 3LCV SAM 0.00001306 0.54609 20.2847
528 4J56 FAD 0.01459 0.42548 21.9298
529 2GAG NAD 0.009572 0.42809 25.2525
530 2GAG FOA 0.02375 0.41555 25.2525
531 2GAG FAD 0.02375 0.41555 25.2525
532 2F5Z FAD 0.0073 0.43978 28.125
533 3G08 FEE 0.03549 0.41104 29.2929
534 5DX0 SFG 0.00005611 0.52042 30
535 5DWQ SFG 0.00005559 0.51864 30
536 5F2K SAH 0.00000003223 0.68806 38.8587
537 5F2K OCA 0.00000003223 0.68806 38.8587
Pocket No.: 3; Query (leader) PDB : 2EG5; Ligand: XTS; 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: 2eg5.bio1) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 2EG5; Ligand: SAH; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 2eg5.bio1) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 2EG5; Ligand: XTS; Similar sites found: 4
This union binding pocket(no: 5) in the query (biounit: 2eg5.bio2) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1RO7 CSF 0.01906 0.40395 2.3166
2 3Q9T FAY 0.03916 0.4008 5.37634
3 5G5W R8C 0.007042 0.42649 7.5
4 3F3E LEU 0.03834 0.40128 8.33333
Pocket No.: 6; Query (leader) PDB : 2EG5; Ligand: SAH; Similar sites found: 30
This union binding pocket(no: 6) in the query (biounit: 2eg5.bio2) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5FJN BE2 0.02611 0.41685 1.34409
2 5FJN FAD 0.02338 0.41685 1.34409
3 3NTD FAD 0.009581 0.43298 1.6129
4 3UMV FAD 0.02374 0.40063 1.88172
5 1GPE FAD 0.004988 0.45413 2.15054
6 1W8D NAP 0.01967 0.40186 2.31788
7 4UP3 FAD 0.03865 0.40382 2.54777
8 5KKA 6V0 0.03137 0.40062 2.5641
9 4USR FAD 0.02393 0.40765 2.77008
10 3A4V PYR 0.03099 0.40505 3.47003
11 3A4V NAD 0.03099 0.40505 3.47003
12 1KEW NAD 0.04132 0.41008 3.87812
13 3HAZ FAD 0.021 0.40824 4.30108
14 1T26 NAI 0.03133 0.41027 4.34783
15 5G3U ITW 0.017 0.42572 4.83871
16 5I39 FAD 0.01366 0.42514 4.83871
17 1H82 GZZ 0.01555 0.43869 5.10753
18 1H82 FAD 0.01346 0.43869 5.10753
19 4J36 1HR 0.01514 0.42748 5.54217
20 2RGO FAD 0.02309 0.41255 5.64516
21 4NBT NAD 0.02523 0.40187 5.83333
22 4CDN FAD 0.02358 0.40207 5.91398
23 4OPC PGT 0.03876 0.43419 6.1828
24 4OPC FDA 0.03496 0.43401 6.1828
25 3RFV NAI 0.01909 0.4066 7.11611
26 2IVF MGD 0.04041 0.40103 7.52688
27 1H5Q NAP 0.02717 0.40264 8.67924
28 3AD8 NAD 0.007089 0.43529 9.13978
29 3VPH OXM 0.02612 0.40783 9.67742
30 1G8K MGD 0.0443 0.41761 10.5263
Pocket No.: 7; Query (leader) PDB : 2EG5; Ligand: XTS; 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: 2eg5.bio2) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 2EG5; Ligand: SAH; 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: 2eg5.bio2) has 17 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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