Receptor
PDB id Resolution Class Description Source Keywords
5JE5 1.56 Å EC: 2.-.-.- CRYSTAL STRUCTURE OF BURKHOLDERIA GLUMAE TOXA WITH BOUND S- ADENOSYLHOMOCYSTEINE (SAH) AND 1-DEMETHYLTOXOFLAVIN BURKHOLDERIA GLUMAE N-METHYLTRANSFERASE S-ADENOSYLMETHIONINE (SAM) PRODUCT COTRANSFERASE
Ref.: BURKHOLDERIA GLUMAE TOXA IS A DUAL-SPECIFICITY METHYLTRANSFERASE THAT CATALYZES THE LAST TWO STEPS TOXOFLAVIN BIOSYNTHESIS. BIOCHEMISTRY V. 55 2748 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
SAH A:301;
Valid;
none;
submit data
384.411 C14 H20 N6 O5 S c1nc(...
AZ9 A:302;
Valid;
none;
submit data
179.136 C6 H5 N5 O2 CN1C(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5JE0 1.55 Å EC: 2.-.-.- CRYSTAL STRUCTURE OF BURKHOLDERIA GLUMAE TOXA WITH BOUND S- ADENOSYLHOMOCYSTEINE (SAH) AND 1,6-DIDEMETHYLTOXOFLAVIN BURKHOLDERIA GLUMAE N-METHYLTRANSFERASE S-ADENOSYLMETHIONINE (SAM) SUBSTRATE TRANSFERASE
Ref.: BURKHOLDERIA GLUMAE TOXA IS A DUAL-SPECIFICITY METHYLTRANSFERASE THAT CATALYZES THE LAST TWO STEPS TOXOFLAVIN BIOSYNTHESIS. BIOCHEMISTRY V. 55 2748 2016
Members (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 313 families.
1 5JE0 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 5JE2 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
3 5JDZ - SAH C14 H20 N6 O5 S c1nc(c2c(n....
4 5JDY - SAH C14 H20 N6 O5 S c1nc(c2c(n....
5 5JE5 - AZ9 C6 H5 N5 O2 CN1C(=O)c2....
6 5JE1 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
7 5JE3 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
8 5JE4 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
70% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 277 families.
1 5JE0 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 5JE2 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
3 5JDZ - SAH C14 H20 N6 O5 S c1nc(c2c(n....
4 5JDY - SAH C14 H20 N6 O5 S c1nc(c2c(n....
5 5JE5 - AZ9 C6 H5 N5 O2 CN1C(=O)c2....
6 5JE1 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
7 5JE3 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
8 5JE4 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 212 families.
1 5JE0 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
2 5JE2 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
3 5JDZ - SAH C14 H20 N6 O5 S c1nc(c2c(n....
4 5JDY - SAH C14 H20 N6 O5 S c1nc(c2c(n....
5 5JE5 - AZ9 C6 H5 N5 O2 CN1C(=O)c2....
6 5JE1 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
7 5JE3 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
8 5JE4 - SAH C14 H20 N6 O5 S c1nc(c2c(n....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: SAH; Similar ligands found: 256
No: Ligand ECFP6 Tc MDL keys Tc
1 SAH 1 1
2 5X8 0.759494 0.969697
3 A7D 0.734177 0.926471
4 TT8 0.709302 0.970588
5 DSH 0.692308 0.914286
6 SXZ 0.692308 0.916667
7 DTA 0.666667 0.857143
8 3DH 0.662338 0.869565
9 S8M 0.655556 0.901408
10 U4Y 0.64 0.956522
11 SFG 0.635294 0.954545
12 SA8 0.62069 0.915493
13 EEM 0.617977 0.890411
14 MTA 0.615385 0.869565
15 SAI 0.613636 0.955882
16 S7M 0.586957 0.916667
17 36A 0.586538 0.90411
18 K15 0.583333 0.878378
19 ADN 0.573333 0.84058
20 RAB 0.573333 0.84058
21 XYA 0.573333 0.84058
22 62X 0.572917 0.855263
23 5CD 0.571429 0.852941
24 0UM 0.5625 0.876712
25 5N5 0.558442 0.84058
26 A4D 0.551282 0.867647
27 KYE 0.54902 0.866667
28 SAM 0.537634 0.916667
29 SSA 0.536842 0.712644
30 SMM 0.536842 0.88
31 KB1 0.534653 0.902778
32 A5D 0.532609 0.857143
33 SIB 0.53125 0.928571
34 EP4 0.530864 0.819444
35 DSZ 0.530612 0.732558
36 GSU 0.53 0.752941
37 LMS 0.529412 0.694118
38 AMP 0.529412 0.763158
39 A 0.529412 0.763158
40 5CA 0.525773 0.712644
41 ME8 0.524752 0.8125
42 M2T 0.52439 0.821918
43 6RE 0.523256 0.824324
44 GJV 0.522727 0.813333
45 OZP 0.518519 0.915493
46 AAT 0.515789 0.863014
47 LSS 0.515152 0.696629
48 KAA 0.514852 0.727273
49 KXW 0.514019 0.915493
50 NWW 0.5125 0.80597
51 J7C 0.511364 0.835616
52 KG4 0.51087 0.769231
53 A5A 0.510417 0.697674
54 AMP MG 0.505747 0.773333
55 SON 0.505495 0.805195
56 SRP 0.505155 0.805195
57 F0P 0.504505 0.915493
58 KH3 0.5 0.866667
59 HY8 0.5 0.890411
60 CA0 0.5 0.769231
61 AMO 0.5 0.805195
62 54H 0.5 0.681818
63 ADX 0.5 0.694118
64 5AL 0.5 0.779221
65 VMS 0.5 0.681818
66 N37 0.495495 0.9
67 HZ2 0.495413 0.890411
68 NVA LMS 0.49505 0.707865
69 AHX 0.49505 0.753086
70 TSB 0.494949 0.689655
71 53H 0.494949 0.674157
72 G5A 0.494737 0.712644
73 45A 0.494382 0.74359
74 ABM 0.494382 0.74359
75 A2D 0.494382 0.74359
76 ZAS 0.494253 0.808219
77 A6D 0.490196 0.759494
78 GEK 0.49 0.956522
79 8QN 0.49 0.779221
80 GAP 0.489583 0.769231
81 A3S 0.48913 0.884058
82 AN2 0.48913 0.734177
83 S4M 0.488889 0.831169
84 SRA 0.488636 0.746835
85 EU9 0.486486 0.825
86 LAD 0.485437 0.810127
87 52H 0.484848 0.674157
88 V2G 0.484536 0.753086
89 BA3 0.483516 0.74359
90 AP2 0.483516 0.759494
91 A12 0.483516 0.759494
92 AOC 0.483146 0.842857
93 NEC 0.483146 0.788732
94 Y3J 0.481481 0.768116
95 VRT 0.479167 0.861111
96 50T 0.478723 0.734177
97 AP5 0.478261 0.74359
98 ADP 0.478261 0.74359
99 5AS 0.478261 0.655556
100 B4P 0.478261 0.74359
101 Q34 0.477876 0.866667
102 Q2M 0.477876 0.916667
103 A3N 0.477778 0.830986
104 YSA 0.476636 0.712644
105 XAH 0.476636 0.768293
106 8LH 0.474747 0.759494
107 V47 0.474747 0.882353
108 0XU 0.473684 0.897059
109 AT4 0.473118 0.7375
110 ADP MG 0.473118 0.763158
111 ADP BEF 0.473118 0.763158
112 J4G 0.471154 0.818182
113 WAQ 0.471154 0.807692
114 NSS 0.470588 0.712644
115 8LE 0.469388 0.75
116 5AD 0.468354 0.791045
117 AU1 0.468085 0.725
118 M33 0.468085 0.734177
119 MAO 0.467391 0.797468
120 NB8 0.466667 0.775
121 A3G 0.466667 0.871429
122 N5O 0.466667 0.857143
123 TXA 0.466667 0.759494
124 3AM 0.465909 0.727273
125 Q2V 0.465517 0.902778
126 QA7 0.465347 0.75
127 8X1 0.465347 0.707865
128 DAL AMP 0.465347 0.779221
129 8LQ 0.465347 0.782051
130 A3T 0.463158 0.842857
131 ATP 0.463158 0.74359
132 ACP 0.463158 0.746835
133 HEJ 0.463158 0.74359
134 7D7 0.4625 0.785714
135 QXP 0.460784 0.697674
136 9ZA 0.460784 0.740741
137 9ZD 0.460784 0.740741
138 APR 0.458333 0.766234
139 5FA 0.458333 0.74359
140 PRX 0.458333 0.746835
141 APC 0.458333 0.759494
142 AQP 0.458333 0.74359
143 AR6 0.458333 0.766234
144 F2R 0.457627 0.75
145 R2V 0.457143 0.697674
146 IOT 0.456897 0.761905
147 N5A 0.456522 0.855072
148 PAJ 0.456311 0.722892
149 4AD 0.456311 0.794872
150 WSA 0.45614 0.72093
151 HQG 0.455446 0.75641
152 NWQ 0.454545 0.782609
153 Q2P 0.453782 0.866667
154 8PZ 0.453704 0.712644
155 FA5 0.453704 0.805195
156 AGS 0.453608 0.728395
157 APC MG 0.453608 0.766234
158 RBY 0.453608 0.782051
159 ATP MG 0.453608 0.763158
160 AD9 0.453608 0.725
161 ADV 0.453608 0.782051
162 NVA 2AD 0.453608 0.849315
163 ADP PO3 0.453608 0.763158
164 PTJ 0.45283 0.731707
165 MHZ 0.452632 0.797468
166 00A 0.451923 0.740741
167 A3P 0.451613 0.74026
168 YLP 0.451327 0.771084
169 7MD 0.45045 0.768293
170 ALF ADP 0.45 0.707317
171 BEF ADP 0.44898 0.74359
172 2VA 0.447917 0.819444
173 H1Q 0.447917 0.753247
174 LEU LMS 0.447619 0.724138
175 QXG 0.447619 0.689655
176 OOB 0.446602 0.779221
177 ACQ 0.444444 0.746835
178 T99 0.444444 0.7375
179 TAT 0.444444 0.7375
180 ANP 0.444444 0.725
181 P5A 0.443396 0.719101
182 7D5 0.443182 0.708861
183 A1R 0.442308 0.7625
184 YLC 0.439655 0.790123
185 2AM 0.438202 0.717949
186 DLL 0.438095 0.779221
187 ARG AMP 0.4375 0.759036
188 KY2 0.436893 0.84
189 D3Y 0.436893 0.859155
190 A22 0.436893 0.734177
191 ANP MG 0.435644 0.734177
192 VO4 ADP 0.435644 0.725
193 ATF 0.435644 0.716049
194 MYR AMP 0.435185 0.746988
195 80F 0.434426 0.75
196 SO8 0.434343 0.808219
197 OAD 0.433962 0.769231
198 3UK 0.433962 0.769231
199 TAD 0.433628 0.765432
200 25A 0.432692 0.74359
201 6YZ 0.431373 0.746835
202 9SN 0.431193 0.731707
203 TYM 0.431034 0.805195
204 PR8 0.429907 0.8
205 B5V 0.429907 0.759494
206 KYB 0.428571 0.84
207 ADQ 0.428571 0.746835
208 YLB 0.42735 0.771084
209 1ZZ 0.425926 0.746988
210 9K8 0.425926 0.67033
211 3OD 0.425926 0.769231
212 FYA 0.425926 0.779221
213 PPS 0.425743 0.674419
214 JNT 0.424528 0.746835
215 B1U 0.423423 0.638298
216 MAP 0.423077 0.707317
217 4YB 0.421053 0.735632
218 A2P 0.421053 0.727273
219 9X8 0.420561 0.75
220 ADP BMA 0.420561 0.746835
221 OZV 0.419048 0.74359
222 5SV 0.419048 0.731707
223 YLA 0.416667 0.771084
224 3NZ 0.416667 0.824324
225 NX8 0.415842 0.875
226 KL2 0.41573 0.692308
227 8Q2 0.415254 0.688889
228 A3R 0.415094 0.7625
229 B5M 0.414414 0.75
230 B5Y 0.414414 0.75
231 LPA AMP 0.413793 0.768293
232 48N 0.413793 0.753086
233 AYB 0.413223 0.761905
234 ACK 0.413043 0.710526
235 QQY 0.413043 0.696203
236 JB6 0.412844 0.7625
237 BIS 0.412844 0.719512
238 K2H 0.411215 0.797297
239 PAP 0.41 0.730769
240 KY5 0.409091 0.887324
241 DQV 0.408696 0.75641
242 OVE 0.408602 0.7125
243 4UV 0.40708 0.75
244 AMP DBH 0.40708 0.746835
245 3AD 0.406977 0.852941
246 OMR 0.40678 0.738095
247 AF3 ADP 3PG 0.40678 0.743902
248 K38 0.405405 0.797297
249 LAQ 0.405172 0.768293
250 K2K 0.40367 0.875
251 7C5 0.403509 0.789474
252 7MC 0.403361 0.75
253 K3K 0.401786 0.797297
254 KOY 0.401709 0.847222
255 NWZ 0.4 0.861111
256 4UU 0.4 0.75
Ligand no: 2; Ligand: AZ9; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 AZ9 1 1
2 AZ8 0.423077 0.788462
Similar Ligands (3D)
Ligand no: 1; Ligand: SAH; Similar ligands found: 15
No: Ligand Similarity coefficient
1 HCE 0.9148
2 GMD 0.9105
3 IDP 0.8930
4 GDP 0.8927
5 2EL 0.8907
6 GDP MG 0.8895
7 CUU 0.8893
8 BIG 0.8840
9 M7G 0.8830
10 DAT 0.8738
11 UC5 0.8671
12 4CT 0.8669
13 DTP 0.8653
14 GNH 0.8616
15 OS3 0.8593
Ligand no: 2; Ligand: AZ9; Similar ligands found: 1119
No: Ligand Similarity coefficient
1 BGC 1.0000
2 0N7 0.9992
3 HQD 0.9988
4 GLC 0.9904
5 3PF 0.9852
6 TOF 0.9819
7 KJH 0.9807
8 TTL 0.9807
9 7W1 0.9792
10 5QY 0.9781
11 5QX 0.9780
12 G3E 0.9777
13 D48 0.9758
14 HQT 0.9752
15 R8V 0.9748
16 Q24 0.9744
17 PE0 0.9744
18 J9W 0.9740
19 SE2 0.9739
20 9KT 0.9728
21 BDP 0.9727
22 AJ2 0.9726
23 2FQ 0.9725
24 AQO 0.9724
25 J5I 0.9723
26 LI6 0.9717
27 4HC 0.9717
28 M6N 0.9715
29 M5K 0.9715
30 MEW 0.9710
31 12Q 0.9708
32 BEA 0.9684
33 PXL 0.9679
34 SKA 0.9673
35 M1Q 0.9656
36 EA1 0.9653
37 CFF 0.9647
38 URC 0.9635
39 APZ 0.9632
40 5WV 0.9626
41 DIN 0.9619
42 TEP 0.9619
43 8CM 0.9616
44 A7W 0.9615
45 0P6 0.9614
46 1NP 0.9610
47 ISN 0.9607
48 3ID 0.9607
49 5Q0 0.9606
50 5SG 0.9606
51 N5J 0.9602
52 4YS 0.9602
53 HQY 0.9601
54 KT7 0.9599
55 DMD 0.9594
56 1SQ 0.9592
57 67N 0.9592
58 MUA 0.9592
59 JBH 0.9591
60 JPZ 0.9591
61 ES7 0.9589
62 5IQ 0.9589
63 O72 0.9587
64 92K 0.9582
65 4AA 0.9582
66 209 0.9582
67 ES1 0.9581
68 GDE 0.9579
69 GAL 0.9576
70 4MU 0.9575
71 KKN 0.9573
72 B62 0.9573
73 NQ 0.9571
74 1LQ 0.9570
75 1LM 0.9567
76 XHP 0.9567
77 PEY 0.9562
78 G3F 0.9562
79 RXA 0.9561
80 AJV 0.9560
81 VK3 0.9559
82 CWS 0.9559
83 CTS 0.9557
84 15L 0.9556
85 AZA 0.9553
86 QX4 0.9552
87 IV2 0.9551
88 QX2 0.9551
89 7W4 0.9550
90 37T 0.9549
91 MRW 0.9546
92 7VS 0.9544
93 KUF 0.9543
94 24W 0.9542
95 GUN 0.9540
96 9DG 0.9539
97 PYQ 0.9536
98 OTW 0.9534
99 DQU 0.9533
100 J9Q 0.9533
101 CFP 0.9532
102 B60 0.9531
103 QWW 0.9530
104 39O 0.9528
105 NOJ 0.9527
106 97T 0.9526
107 BTY 0.9525
108 M0Q 0.9525
109 44W 0.9524
110 H33 0.9521
111 QBK 0.9521
112 IGA 0.9517
113 0FO 0.9517
114 JG8 0.9516
115 M0W 0.9516
116 XAN 0.9513
117 MAQ 0.9509
118 E7Z 0.9507
119 M1A 0.9507
120 COU 0.9506
121 9FL 0.9506
122 LT2 0.9506
123 9MG 0.9504
124 XAZ 0.9502
125 OCH 0.9500
126 2AQ 0.9500
127 75K 0.9498
128 86J 0.9498
129 141 0.9498
130 QWN 0.9498
131 GCS 0.9497
132 6RQ 0.9495
133 32X 0.9493
134 PHH 0.9492
135 4NC 0.9489
136 5JQ 0.9487
137 44V 0.9486
138 03V 0.9483
139 ES5 0.9482
140 3HA 0.9478
141 4FS 0.9477
142 495 0.9477
143 XX2 0.9476
144 DHB 0.9475
145 A2F 0.9475
146 DRL 0.9475
147 M1H 0.9475
148 UNC 0.9473
149 8TX 0.9473
150 MYJ 0.9472
151 MT0 0.9470
152 5CU 0.9467
153 SKM 0.9464
154 G6D 0.9464
155 2AK 0.9461
156 1IT 0.9461
157 JLZ 0.9461
158 5NU 0.9460
159 ES0 0.9460
160 7ZE 0.9460
161 JBQ 0.9459
162 6VD 0.9459
163 6AP 0.9458
164 INO 0.9454
165 B55 0.9454
166 HLZ 0.9453
167 DOB 0.9453
168 3F0 0.9453
169 FA0 0.9451
170 2HO 0.9450
171 Z5P 0.9448
172 290 0.9447
173 5WY 0.9447
174 FHB 0.9446
175 3HM 0.9446
176 8S0 0.9445
177 B57 0.9444
178 4A3 0.9441
179 DBH 0.9439
180 3IT 0.9438
181 3WA 0.9436
182 4XH 0.9436
183 AZG 0.9435
184 JBK 0.9435
185 93K 0.9435
186 P9P 0.9435
187 YH7 0.9433
188 MVN 0.9432
189 JUG 0.9432
190 CWM 0.9432
191 NDH 0.9430
192 BHA 0.9430
193 5RO 0.9428
194 CTL 0.9428
195 NNO 0.9427
196 Q6T 0.9427
197 DHK 0.9427
198 FE DB1 0.9426
199 FDB 0.9426
200 7NI 0.9425
201 HZQ 0.9421
202 DX4 0.9420
203 9CA 0.9420
204 2D0 0.9419
205 H42 0.9419
206 3Z8 0.9418
207 DHQ 0.9418
208 BOA 0.9417
209 HH8 0.9416
210 KJY 0.9415
211 M2K 0.9415
212 MQN 0.9413
213 2ZQ 0.9411
214 MO8 0.9411
215 3M0 0.9411
216 Q88 0.9411
217 GTR 0.9411
218 X05 0.9410
219 2HQ 0.9410
220 G1O 0.9409
221 HJP 0.9409
222 15E 0.9409
223 G12 0.9408
224 4JQ 0.9408
225 QXW 0.9407
226 5RN 0.9406
227 PFB 0.9406
228 4ME 0.9406
229 0F9 0.9406
230 EVA 0.9400
231 25W 0.9400
232 4M0 0.9399
233 IJZ 0.9398
234 FOT 0.9398
235 1XN 0.9396
236 X8D 0.9393
237 GCU 0.9392
238 G5V 0.9389
239 1XM 0.9389
240 F31 0.9389
241 KJU 0.9385
242 JB5 0.9384
243 0TU 0.9382
244 CHB 0.9381
245 CLZ 0.9378
246 TBS 0.9378
247 1KP 0.9377
248 XQ0 0.9377
249 0W8 0.9376
250 GZL 0.9375
251 4Z4 0.9374
252 0FN 0.9374
253 ICO 0.9372
254 AKH 0.9367
255 RM1 0.9365
256 4YO 0.9363
257 9TW 0.9361
258 7HQ 0.9360
259 I3A 0.9360
260 QSH 0.9359
261 CH9 0.9357
262 12B 0.9355
263 42C 0.9354
264 VNL 0.9354
265 173 0.9353
266 5JL 0.9352
267 5RG 0.9352
268 6ME 0.9352
269 TTY 0.9352
270 HIS 0.9351
271 LDR 0.9350
272 30G 0.9349
273 SYA 0.9347
274 ZYR 0.9344
275 AA 0.9344
276 MS9 0.9343
277 DNF 0.9343
278 5OB 0.9341
279 QPR 0.9339
280 NID 0.9338
281 A29 0.9336
282 FGZ 0.9336
283 4RU 0.9335
284 UAN 0.9335
285 DPZ 0.9334
286 ADZ 0.9332
287 ISE 0.9327
288 BSP 0.9322
289 K17 0.9322
290 9AP 0.9320
291 HNQ 0.9319
292 7B3 0.9318
293 7WR 0.9313
294 ET2 0.9310
295 5GU 0.9310
296 2FY 0.9309
297 GTQ 0.9309
298 INE 0.9309
299 GYE 0.9309
300 ANF 0.9307
301 FLV 0.9302
302 NPY 0.9299
303 OXC 0.9298
304 8IG 0.9298
305 I6G 0.9298
306 0HO 0.9297
307 QUZ 0.9297
308 SWA 0.9296
309 BCP 0.9295
310 52C 0.9295
311 EQT 0.9294
312 SVN 0.9294
313 PQ0 0.9294
314 CLW 0.9293
315 0HN 0.9291
316 DBJ 0.9290
317 6M9 0.9290
318 2H5 0.9290
319 6BL 0.9289
320 6NT 0.9289
321 3MG 0.9289
322 HH5 0.9288
323 SOE 0.9286
324 SAL 0.9285
325 7B4 0.9284
326 OA3 0.9283
327 N8Y 0.9282
328 BPU 0.9281
329 NTZ 0.9281
330 B53 0.9280
331 FBB 0.9279
332 ES2 0.9277
333 K32 0.9277
334 GJP 0.9276
335 5M0 0.9276
336 54G 0.9273
337 1P8 0.9272
338 1HN 0.9272
339 226 0.9271
340 2LY 0.9270
341 92P 0.9269
342 IHB 0.9268
343 Q71 0.9268
344 36R 0.9267
345 1P7 0.9267
346 2AL 0.9266
347 2ZM 0.9265
348 LSA 0.9265
349 SYV 0.9264
350 F5B 0.9264
351 3NY 0.9263
352 JYB 0.9263
353 ODO 0.9260
354 AJY 0.9259
355 SHG 0.9259
356 0CU 0.9257
357 M1E 0.9257
358 PX7 0.9257
359 K2T 0.9256
360 VGD 0.9255
361 C2Y 0.9255
362 UFV 0.9255
363 PJW 0.9255
364 4XV 0.9251
365 9EW 0.9251
366 HHA 0.9250
367 JTH 0.9250
368 5VL 0.9250
369 ORO 0.9249
370 LZM 0.9249
371 2CK 0.9247
372 DNA 0.9246
373 UFO 0.9246
374 D07 0.9245
375 ONR 0.9245
376 BZX 0.9244
377 JXN 0.9244
378 8WO 0.9244
379 8XQ 0.9242
380 FDR 0.9242
381 4SV 0.9242
382 HKD 0.9242
383 BZ3 0.9242
384 14O 0.9241
385 2K4 0.9239
386 HQJ 0.9238
387 149 0.9238
388 NDM 0.9237
389 F60 0.9236
390 5WX 0.9235
391 F05 0.9234
392 GF4 0.9233
393 5H1 0.9232
394 39A 0.9230
395 BE2 0.9230
396 15N 0.9230
397 GCB 0.9229
398 6CS 0.9229
399 2HU 0.9227
400 C2U 0.9225
401 X09 0.9224
402 8ZE 0.9224
403 4CS 0.9223
404 BPY 0.9222
405 GJS 0.9221
406 0RW 0.9221
407 28N 0.9221
408 8W9 0.9220
409 2KA 0.9219
410 L99 0.9219
411 LGC 0.9218
412 KYA 0.9217
413 ES6 0.9217
414 IFP 0.9216
415 3A9 0.9214
416 5MI 0.9214
417 HPA 0.9214
418 34D 0.9213
419 0JD 0.9213
420 3QV 0.9212
421 4JT 0.9210
422 GM7 0.9210
423 5HN 0.9209
424 K22 0.9209
425 680 0.9208
426 ZVO 0.9208
427 ABI 0.9207
428 GRE 0.9205
429 4TU 0.9204
430 JU2 0.9204
431 3HB 0.9203
432 3U4 0.9203
433 5NI 0.9202
434 8GC 0.9202
435 DNC 0.9202
436 GAB 0.9199
437 SXS 0.9199
438 AN3 0.9198
439 ASO 0.9197
440 XXR 0.9197
441 3NT 0.9196
442 10L 0.9195
443 6NI 0.9195
444 GIM 0.9195
445 AW5 0.9194
446 5MB 0.9192
447 3FH 0.9192
448 BTE 0.9191
449 1F1 0.9191
450 Q7A 0.9191
451 TT4 0.9190
452 BZJ 0.9189
453 5B1 0.9189
454 3AB 0.9187
455 HTP 0.9186
456 6AI 0.9185
457 AX7 0.9185
458 42A 0.9184
459 20J 0.9182
460 SHA 0.9181
461 OVV 0.9180
462 6GU 0.9180
463 F12 0.9179
464 JKE 0.9175
465 5VM 0.9175
466 9TZ 0.9175
467 EXO 0.9175
468 6F0 0.9174
469 6QF 0.9173
470 PRF 0.9172
471 X0V 0.9171
472 H5B 0.9170
473 L5V 0.9170
474 N2I 0.9170
475 ADA 0.9170
476 270 0.9169
477 2ZV 0.9168
478 THA 0.9168
479 JAE 0.9167
480 6M4 0.9167
481 1WD 0.9165
482 4XS 0.9164
483 7WA 0.9164
484 PH2 0.9164
485 11S 0.9163
486 6M1 0.9162
487 HA5 0.9162
488 7WV 0.9161
489 INS 0.9161
490 K6X 0.9157
491 KBG 0.9157
492 53C 0.9157
493 2FG 0.9157
494 4SX 0.9155
495 GIO 0.9149
496 3J8 0.9148
497 5MK 0.9148
498 ABV 0.9148
499 GLA 0.9148
500 XXP 0.9148
501 TIY 0.9147
502 9R5 0.9147
503 5XC 0.9144
504 1GN 0.9144
505 RPQ 0.9143
506 E7S 0.9143
507 ES9 0.9141
508 NAG 0.9140
509 VXX 0.9139
510 L7T 0.9138
511 9DA 0.9137
512 8HC 0.9137
513 JAW 0.9136
514 DIU 0.9136
515 5NE 0.9135
516 7HP 0.9134
517 8WT 0.9134
518 9HX 0.9132
519 E1T 0.9132
520 1U6 0.9132
521 MT5 0.9130
522 2EC 0.9130
523 AY4 0.9130
524 4FH 0.9128
525 D1X 0.9127
526 KGK 0.9125
527 NGO 0.9125
528 ADE 0.9122
529 0XT 0.9122
530 DOR 0.9122
531 DRG 0.9121
532 0FK 0.9121
533 DPT 0.9120
534 WCE 0.9119
535 MWP 0.9118
536 PDC 0.9118
537 2MI 0.9117
538 FK1 0.9117
539 EKZ 0.9116
540 B5D 0.9116
541 AEZ 0.9114
542 K8X 0.9113
543 82I 0.9112
544 SX1 0.9111
545 H4N 0.9110
546 GZ8 0.9110
547 GVG 0.9110
548 6TZ 0.9110
549 5CL 0.9108
550 ROI 0.9107
551 23A 0.9106
552 G2F 0.9104
553 ASC 0.9103
554 PHB 0.9103
555 QIC 0.9102
556 TWO 0.9101
557 1A7 0.9100
558 3BZ 0.9100
559 329 0.9099
560 JBE 0.9099
561 K5W 0.9098
562 EN1 0.9097
563 DX3 0.9093
564 GIV 0.9093
565 NPO 0.9091
566 FBG 0.9091
567 MVL 0.9091
568 BP1 0.9090
569 HFB 0.9090
570 QAT 0.9090
571 DQN 0.9087
572 1DW 0.9086
573 4P5 0.9085
574 K3Q 0.9085
575 XYP 0.9084
576 PHT 0.9083
577 SRO 0.9083
578 XM0 0.9083
579 1WG 0.9082
580 GNM 0.9082
581 KDV 0.9081
582 GCO 0.9081
583 HBD 0.9080
584 4KL 0.9079
585 HHR 0.9076
586 TGX 0.9074
587 NMJ 0.9074
588 EYK 0.9073
589 AHR 0.9073
590 XQK 0.9070
591 NTM 0.9069
592 GAF 0.9069
593 PRZ 0.9069
594 344 0.9068
595 2CQ 0.9068
596 LKA 0.9067
597 JA8 0.9065
598 BHO 0.9065
599 6MP 0.9065
600 5NS 0.9064
601 4XR 0.9064
602 BRT 0.9063
603 P92 0.9062
604 IPB 0.9060
605 KIB 0.9059
606 12T 0.9057
607 FYU 0.9057
608 A13 0.9056
609 KFH 0.9054
610 V55 0.9054
611 3RK 0.9054
612 PCI 0.9053
613 23J 0.9053
614 2F6 0.9053
615 PM6 0.9052
616 LXC 0.9051
617 OVM 0.9048
618 JDN 0.9045
619 7MU 0.9044
620 GOG 0.9043
621 QAS 0.9043
622 RAM 0.9043
623 KLW 0.9042
624 3MB 0.9042
625 DBX 0.9041
626 BCF 0.9041
627 8MO 0.9040
628 8NY 0.9039
629 4HM 0.9039
630 BNT 0.9037
631 BK9 0.9037
632 PAB 0.9037
633 8XL 0.9037
634 1Y6 0.9035
635 NCT 0.9035
636 PHE 0.9035
637 HLR 0.9034
638 SOR 0.9032
639 ES4 0.9031
640 27B 0.9023
641 F2W 0.9023
642 BZ2 0.9022
643 KOJ 0.9020
644 MBG 0.9020
645 XQG 0.9019
646 39U 0.9019
647 CWJ 0.9018
648 HMH 0.9016
649 QSB 0.9014
650 FBT 0.9014
651 1M2 0.9013
652 FA3 0.9012
653 YIO 0.9011
654 JXW 0.9008
655 BBF 0.9006
656 NVU 0.9005
657 N2Z 0.9004
658 JB8 0.9004
659 K97 0.9004
660 ANC 0.9003
661 OMD 0.9001
662 4ZA 0.8999
663 94W 0.8999
664 150 0.8998
665 HBO 0.8998
666 JR2 0.8998
667 F0J 0.8997
668 X0W 0.8996
669 YSO 0.8995
670 LDP 0.8995
671 MR1 0.8994
672 BCU 0.8993
673 IBF 0.8991
674 O2A 0.8989
675 EUG 0.8989
676 XIY 0.8988
677 YQA 0.8984
678 091 0.8984
679 069 0.8984
680 4MA 0.8983
681 826 0.8982
682 LNR 0.8982
683 9FE 0.8980
684 68A 0.8978
685 7MX 0.8978
686 I1N 0.8977
687 PBA 0.8976
688 4AN 0.8976
689 9ZE 0.8975
690 TIU 0.8974
691 06B 0.8972
692 PIY 0.8972
693 TH7 0.8971
694 E3D 0.8971
695 Q77 0.8971
696 MAN 0.8969
697 PXM 0.8969
698 ZZ8 0.8968
699 OW4 0.8967
700 ADK 0.8966
701 51R 0.8966
702 UEG 0.8966
703 F9Y 0.8964
704 7ME 0.8964
705 KBB 0.8963
706 GV9 0.8961
707 2A7 0.8961
708 APG 0.8961
709 3DM 0.8960
710 7VJ 0.8960
711 GOX 0.8959
712 ISZ 0.8958
713 SW7 0.8958
714 4WL 0.8958
715 S76 0.8958
716 MSR 0.8957
717 X6X 0.8956
718 GXL 0.8954
719 PBZ 0.8953
720 PIM 0.8953
721 ICB 0.8950
722 HDH 0.8950
723 EJZ 0.8950
724 SVD 0.8950
725 4M4 0.8950
726 0W1 0.8949
727 BEZ 0.8949
728 CN0 0.8946
729 ESI 0.8946
730 F3B 0.8943
731 8OZ 0.8941
732 174 0.8940
733 R9Y 0.8940
734 V1T 0.8935
735 1WC 0.8935
736 PQK 0.8935
737 HA7 0.8935
738 ALL 0.8934
739 GLT 0.8934
740 8NX 0.8932
741 PD2 0.8932
742 NDG 0.8930
743 MT8 0.8930
744 YCP 0.8930
745 ZZZ 0.8929
746 NCA 0.8929
747 TVP 0.8925
748 FDK 0.8923
749 3DO 0.8922
750 Z82 0.8922
751 0BP 0.8921
752 DGJ 0.8920
753 FBV 0.8919
754 NOY 0.8915
755 WOO 0.8914
756 TZF 0.8913
757 TC7 0.8913
758 KIA 0.8912
759 MZB 0.8911
760 J9T 0.8910
761 1XA 0.8910
762 GXY 0.8910
763 6PC 0.8910
764 7MK 0.8908
765 CFI 0.8908
766 LZ2 0.8906
767 45C 0.8906
768 TSS 0.8905
769 DIE 0.8904
770 ZXD 0.8903
771 JKZ 0.8902
772 SJ5 0.8901
773 R20 0.8899
774 X0U 0.8897
775 HLD 0.8897
776 M4E 0.8897
777 KW8 0.8897
778 537 0.8896
779 5WU 0.8895
780 9PY 0.8895
781 2BG 0.8895
782 HMU 0.8895
783 FBU 0.8894
784 DEE 0.8894
785 DEN 0.8893
786 EXD 0.8892
787 3OC 0.8892
788 FHC 0.8892
789 KJ5 0.8891
790 PZI 0.8891
791 NIZ 0.8891
792 K34 0.8890
793 LCN 0.8890
794 18N 0.8890
795 IFL 0.8889
796 IWT 0.8888
797 P3K 0.8888
798 2O6 0.8887
799 FBW 0.8887
800 PHU 0.8885
801 SLS 0.8884
802 BZI 0.8884
803 JND 0.8881
804 JXZ 0.8881
805 3MA 0.8880
806 5TY 0.8880
807 MPV 0.8880
808 VNJ 0.8880
809 IND 0.8879
810 FH2 0.8879
811 CPZ 0.8879
812 ESX 0.8878
813 EGR 0.8877
814 FP1 0.8877
815 X11 0.8876
816 UNU 0.8874
817 AIN 0.8873
818 APS 0.8873
819 NGT 0.8872
820 2K8 0.8871
821 SNU 0.8870
822 E1K 0.8870
823 FUL 0.8870
824 GSY 0.8870
825 E5X 0.8869
826 RHU 0.8868
827 EMZ 0.8868
828 6X9 0.8866
829 261 0.8862
830 5VJ 0.8861
831 ZZT 0.8861
832 BMA 0.8860
833 8H8 0.8860
834 GCW 0.8860
835 F4Z 0.8860
836 ANN 0.8859
837 8G0 0.8859
838 MOK 0.8859
839 NIO 0.8859
840 TYL 0.8857
841 1X7 0.8857
842 3R6 0.8857
843 MPI 0.8856
844 FB1 0.8854
845 PNZ 0.8853
846 RMN 0.8852
847 M1Z 0.8851
848 4ZC 0.8848
849 PA1 0.8846
850 JIF 0.8845
851 0R1 0.8844
852 UQ 0.8843
853 F81 0.8842
854 NBZ 0.8842
855 FA1 0.8842
856 8GK 0.8842
857 LZ1 0.8840
858 EV0 0.8840
859 3XX 0.8840
860 FUD 0.8839
861 BZF 0.8837
862 HX3 0.8837
863 54X 0.8835
864 N3W 0.8833
865 J6W 0.8832
866 ESP 0.8831
867 Q02 0.8831
868 AC6 0.8830
869 BEN 0.8830
870 K37 0.8830
871 64C 0.8829
872 BIK 0.8827
873 SRT 0.8826
874 4V2 0.8825
875 GBD 0.8825
876 ZWZ 0.8825
877 6KT 0.8825
878 GVH 0.8824
879 67X 0.8823
880 1QP 0.8822
881 IBM 0.8822
882 XYS 0.8822
883 ARP 0.8820
884 0GZ 0.8819
885 F4E 0.8816
886 7I2 0.8815
887 BAM 0.8814
888 IAC 0.8814
889 VGL 0.8810
890 7D2 0.8810
891 XCZ 0.8809
892 CKA 0.8809
893 1P3 0.8809
894 F9P 0.8809
895 JFD 0.8808
896 0CT 0.8807
897 BNL 0.8807
898 6FZ 0.8806
899 7MH 0.8803
900 FUC 0.8803
901 C9E 0.8802
902 UNJ 0.8802
903 XDE 0.8801
904 6R8 0.8801
905 XM5 0.8800
906 JP2 0.8799
907 PZA 0.8799
908 XXG 0.8798
909 2A9 0.8797
910 M5N 0.8796
911 P72 0.8795
912 SS1 0.8795
913 OVP 0.8793
914 GHM 0.8786
915 G4D 0.8785
916 T6C 0.8785
917 NTN 0.8783
918 HHS 0.8781
919 IDM 0.8779
920 IF7 0.8778
921 428 0.8778
922 R8S 0.8777
923 1AL 0.8773
924 KYD 0.8771
925 XX3 0.8770
926 293 0.8768
927 948 0.8767
928 FAN 0.8767
929 KIF 0.8767
930 OXQ 0.8765
931 SYR 0.8765
932 GAG 0.8764
933 AMG 0.8764
934 K44 0.8763
935 0LH 0.8763
936 KTJ 0.8761
937 TSU 0.8761
938 FCR 0.8760
939 AC0 0.8760
940 LYL 0.8759
941 OAA 0.8758
942 CK2 0.8756
943 TXW 0.8756
944 PBC 0.8755
945 4NM 0.8755
946 49O 0.8754
947 2HC 0.8754
948 RM4 0.8754
949 FBM 0.8752
950 L22 0.8751
951 LT8 0.8751
952 3SK 0.8751
953 AX3 0.8751
954 4P0 0.8749
955 4BY 0.8746
956 E35 0.8746
957 HXX 0.8744
958 3R4 0.8742
959 TH0 0.8742
960 9RW 0.8740
961 9UL 0.8740
962 6E8 0.8738
963 3GQ 0.8736
964 6OT 0.8736
965 4BL 0.8734
966 OTD 0.8734
967 BDF 0.8732
968 0TR 0.8731
969 2D3 0.8731
970 DMJ 0.8730
971 60Q 0.8730
972 95Z 0.8728
973 MJ2 0.8727
974 MAJ 0.8726
975 6XI 0.8726
976 MFB 0.8726
977 582 0.8725
978 717 0.8724
979 FCB 0.8724
980 2MN 0.8723
981 NLA 0.8722
982 3ZB 0.8720
983 3C1 0.8720
984 3Z7 0.8720
985 MCT 0.8719
986 5FN 0.8718
987 BPN 0.8718
988 2JK 0.8715
989 3TJ 0.8714
990 VOH 0.8713
991 W81 0.8712
992 60P 0.8711
993 M3H 0.8710
994 6FB 0.8706
995 DHR 0.8705
996 4VS 0.8705
997 2GS 0.8705
998 1Z8 0.8704
999 MHK 0.8702
1000 H6B 0.8702
1001 DFB 0.8701
1002 3C2 0.8700
1003 A5E 0.8697
1004 N0Z 0.8696
1005 ZME 0.8695
1006 URF 0.8694
1007 DQA 0.8694
1008 H62 0.8693
1009 FHN 0.8692
1010 4JP 0.8691
1011 NSP 0.8691
1012 42J 0.8688
1013 RNS 0.8687
1014 GCV 0.8685
1015 SWD 0.8685
1016 5LA 0.8684
1017 MWM 0.8684
1018 XBZ 0.8683
1019 GTZ 0.8680
1020 TPA 0.8680
1021 GNL 0.8678
1022 BA5 0.8677
1023 LAO 0.8676
1024 4NB 0.8674
1025 SAN 0.8673
1026 WBU 0.8671
1027 FBS 0.8671
1028 4AV 0.8670
1029 24B 0.8668
1030 TDR 0.8667
1031 F1A 0.8666
1032 IUP 0.8663
1033 4J8 0.8662
1034 RAT 0.8660
1035 3AL 0.8660
1036 S60 0.8660
1037 JZ9 0.8660
1038 GTL 0.8659
1039 KTW 0.8659
1040 ZZ3 0.8658
1041 1MC 0.8657
1042 4ZE 0.8656
1043 TAG 0.8655
1044 BGU 0.8651
1045 PAC 0.8650
1046 275 0.8650
1047 7VP 0.8650
1048 QSC 0.8650
1049 36Y 0.8649
1050 M6Z 0.8647
1051 43M 0.8647
1052 2AC 0.8645
1053 3Y7 0.8645
1054 4HO 0.8644
1055 TFU 0.8643
1056 259 0.8641
1057 B56 0.8640
1058 FUF 0.8638
1059 2YU 0.8638
1060 DHS 0.8637
1061 2MP 0.8636
1062 QQQ 0.8635
1063 SMN 0.8634
1064 XYD 0.8633
1065 34A 0.8631
1066 AAS 0.8630
1067 5JC 0.8627
1068 5MH 0.8626
1069 DYA 0.8626
1070 5UC 0.8622
1071 DK1 0.8622
1072 E7R 0.8622
1073 D3M 0.8622
1074 J9N 0.8621
1075 LQ2 0.8621
1076 7CZ 0.8620
1077 45L 0.8620
1078 4V6 0.8620
1079 4JJ 0.8614
1080 7FF 0.8614
1081 HBA 0.8612
1082 PYD 0.8612
1083 K25 0.8610
1084 HT4 0.8606
1085 GOO 0.8604
1086 4CL 0.8601
1087 ICP 0.8600
1088 A1U 0.8600
1089 FCA 0.8600
1090 OTR 0.8599
1091 OW7 0.8598
1092 8NB 0.8597
1093 36E 0.8595
1094 NSG 0.8593
1095 PBR 0.8593
1096 JZ2 0.8591
1097 HX4 0.8590
1098 F69 0.8590
1099 MXX 0.8589
1100 JZ3 0.8588
1101 ENL 0.8583
1102 RIB 0.8582
1103 FA6 0.8580
1104 XYL 0.8580
1105 DA4 0.8577
1106 TM7 0.8572
1107 1Z6 0.8562
1108 MWJ 0.8561
1109 GIF 0.8560
1110 IOS 0.8554
1111 IFM 0.8554
1112 MNM 0.8554
1113 X48 0.8553
1114 BR9 0.8549
1115 AEF 0.8540
1116 27Y 0.8538
1117 PKU 0.8535
1118 WOT 0.8530
1119 64E 0.8519
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5JE0; Ligand: AZ8; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 5je0.bio2) has 32 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5JE0; Ligand: SAH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 5je0.bio2) has 32 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 5JE0; Ligand: AZ8; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 5je0.bio1) has 33 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 5JE0; Ligand: SAH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 5je0.bio1) has 33 residues
No: Leader PDB Ligand Sequence Similarity
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