Receptor
PDB id Resolution Class Description Source Keywords
1WNG 2.1 Å EC: 2.1.1.98 STRUCTURAL STUDY OF PROJECT ID PH0725 FROM PYROCOCCUS HORIKOSHII OT3 PYROCOCCUS HORIKOSHII TRANSFERASE METHYLTRANSFERASE STRUCTURAL GENOMICS NPPSFANATIONAL PROJECT ON PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE RSGI
Ref.: STRUCTURES OF TWO ARCHAEAL DIPHTHINE SYNTHASES: INSIGHTS INTO THE POST-TRANSLATIONAL MODIFICATION OF ELONGATION FACTOR 2. ACTA CRYSTALLOGR.,SECT.D V. 64 397 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
SAH A:1300;
Valid;
none;
submit data
384.411 C14 H20 N6 O5 S c1nc(...
SO4 A:1303;
A:1304;
A:1306;
B:1301;
B:1302;
B:1305;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1WNG 2.1 Å EC: 2.1.1.98 STRUCTURAL STUDY OF PROJECT ID PH0725 FROM PYROCOCCUS HORIKOSHII OT3 PYROCOCCUS HORIKOSHII TRANSFERASE METHYLTRANSFERASE STRUCTURAL GENOMICS NPPSFANATIONAL PROJECT ON PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE RSGI
Ref.: STRUCTURES OF TWO ARCHAEAL DIPHTHINE SYNTHASES: INSIGHTS INTO THE POST-TRANSLATIONAL MODIFICATION OF ELONGATION FACTOR 2. ACTA CRYSTALLOGR.,SECT.D V. 64 397 2008
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1WNG - 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 2 families.
1 1WNG - 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 2 families.
1 1WNG - 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 : 1WNG; Ligand: SAH; Similar sites found: 540
This union binding pocket(no: 1) in the query (biounit: 1wng.bio2) has 22 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2QLX RM4 0.002624 0.44628 None
2 2BOI MFU 0.001449 0.438 None
3 2WGC SIA GAL BGC 0.02653 0.42638 None
4 2JGS BTN 0.005413 0.41679 None
5 3D3W NAP 0.002247 0.40989 None
6 1TUV VK3 0.02887 0.40959 None
7 1PR9 NAP 0.002894 0.40861 None
8 2HFK E4H 0.004822 0.41624 0.754717
9 9LDB NAD 0.0009166 0.42354 1.13208
10 9LDT NAD 0.001611 0.41496 1.13208
11 3UEC ALA ARG TPO LYS 0.008344 0.42298 1.36986
12 2J07 HDF 0.000182 0.46911 1.50943
13 2J07 FAD 0.000182 0.46911 1.50943
14 3O03 NAP 0.009074 0.41069 1.50943
15 4I9A NCN 0.002148 0.4078 1.50943
16 1ZZ7 S0H 0.002796 0.42611 1.51515
17 4JEJ 1GP 0.001013 0.42759 1.63934
18 4TMK T5A 0.04389 0.40442 1.87793
19 4NTD FAD 0.001534 0.42439 1.88679
20 4DQ2 BTX 0.00107 0.4183 1.88679
21 3FC2 IBI 0.001293 0.4169 1.88679
22 2ZJF BSU 0.002951 0.41473 1.88679
23 3FPZ AHZ 0.01603 0.41177 1.88679
24 3IU9 T07 0.01214 0.40651 1.88679
25 2RDT 2RD 0.01867 0.40364 1.88679
26 1XVV CCQ 0.007691 0.40003 1.88679
27 1EB9 HBA 0.0003735 0.444 1.9084
28 2AE2 NAP 0.002108 0.42155 1.92308
29 2AE2 PTO 0.002108 0.42155 1.92308
30 5YAS FAC 0.0002326 0.40021 1.94553
31 3MB5 SAM 0.0004665 0.45474 1.96078
32 4C0X AQN 0.003359 0.40377 1.97044
33 4C0X FMN 0.002467 0.40277 1.97044
34 2Y6P CTP 0.0003571 0.45054 2.13675
35 1G8S MET 0.002371 0.44138 2.17391
36 3P3N AKG 0.00006543 0.51093 2.26415
37 2Q1S NAI 0.0002535 0.45851 2.26415
38 3A1I UNU 0.0004056 0.44838 2.26415
39 2Z9V PXM 0.001745 0.43463 2.26415
40 1KTC NGA 0.001889 0.4332 2.26415
41 2WA4 069 0.0009393 0.42884 2.26415
42 2GSD NAD 0.0009609 0.42813 2.26415
43 3DG6 MUC 0.000755 0.42732 2.26415
44 1VJT NAD 0.0003247 0.42143 2.26415
45 4LHM AZZ 0.005051 0.42084 2.26415
46 2XVE FAD 0.006653 0.41864 2.26415
47 2HW1 ANP 0.0005538 0.41587 2.26415
48 1WVG APR 0.001109 0.41305 2.26415
49 1IUP ALQ 0.001991 0.41037 2.26415
50 1YFS ALA 0.02846 0.40811 2.26415
51 3TXO 07U 0.000292 0.40571 2.26415
52 4L7I SAM 0.001808 0.40473 2.26415
53 1P9B IMO 0.001969 0.40292 2.26415
54 2VPR TDC 0.0006902 0.42388 2.41546
55 2ZWS PLM 0.003646 0.47408 2.64151
56 1Y42 TYR 0.0002651 0.4687 2.64151
57 4JWX 1N4 0.0003907 0.46169 2.64151
58 1VDC FAD 0.0006039 0.44864 2.64151
59 4WVH ASP HIS ASP ALA HIS ALA 0.0005716 0.44848 2.64151
60 1V5F FAD 0.01119 0.43812 2.64151
61 1V5F TPP 0.01119 0.43812 2.64151
62 1Q3Q ANP 0.001817 0.43746 2.64151
63 3K3G MMU 0.0021 0.43422 2.64151
64 3P7I P7I 0.002358 0.42919 2.64151
65 3MCT SAH 0.0002273 0.42869 2.64151
66 3I51 45C 0.001061 0.42684 2.64151
67 3MAG 3MA 0.02299 0.42176 2.64151
68 3I8P 840 0.0007949 0.42169 2.64151
69 4AMV F6R 0.0001313 0.42138 2.64151
70 1PL6 572 0.001597 0.41775 2.64151
71 4LCQ URQ 0.001384 0.41443 2.64151
72 3DGB MUC 0.002669 0.41165 2.64151
73 3TFC PEP 0.006584 0.4106 2.64151
74 2WQP WQP 0.001666 0.40861 2.64151
75 1KW6 BPY 0.01263 0.40783 2.64151
76 1SQ5 PAU 0.008764 0.40541 2.64151
77 2Y7G AAE 0.002481 0.40403 2.64151
78 1LVL FAD 0.007872 0.40346 2.64151
79 4NE2 SH2 0.004946 0.4027 2.64151
80 4HZD COA 0.005236 0.40181 2.64151
81 3IL6 B83 0.001361 0.40097 2.64151
82 2EFJ SAH 0.0007914 0.4002 2.64151
83 4NE2 ADP 0.004998 0.4002 2.64151
84 1E7S NAP 0.004629 0.40015 2.64151
85 3CXO 1N5 0.004286 0.40006 2.64151
86 1R18 SAH 0.001214 0.40647 2.64317
87 1M5B BN1 0.002534 0.43193 2.6616
88 1W8S FBP 0.008276 0.40954 2.6616
89 1GU3 BGC BGC BGC BGC BGC 0.0006785 0.45171 2.68456
90 4G28 0W8 0.00007747 0.40442 2.68456
91 2G30 ALA ALA PHE 0.0008247 0.49207 2.71318
92 2VDF OCT 0.0002412 0.51716 2.7668
93 1J5P NAD 0.0008077 0.42099 2.7668
94 3OZG SSI 0.0003394 0.40676 2.8
95 1HDR NAD 0.00229 0.42788 2.86885
96 3RK0 AMP 0.001329 0.42312 2.95359
97 3S2Y FMN 0.0004214 0.41371 3.01508
98 1TDF FAD 0.0003029 0.45883 3.01887
99 1T26 GBD 0.001749 0.45678 3.01887
100 1T26 NAI 0.001749 0.45678 3.01887
101 3OND NAD 0.0004458 0.45356 3.01887
102 3OND ADN 0.0004458 0.45356 3.01887
103 1TDF NAP 0.001585 0.44823 3.01887
104 3MD0 GDP 0.0006906 0.44518 3.01887
105 1MOQ GLP 0.00009318 0.44423 3.01887
106 3TO7 COA 0.0009833 0.43138 3.01887
107 2RCN GDP 0.001436 0.42694 3.01887
108 2R5T ANP 0.0001617 0.42555 3.01887
109 3GWT 066 0.001204 0.4194 3.01887
110 2BII MTV 0.0001114 0.41813 3.01887
111 1KOL NAD 0.002342 0.41548 3.01887
112 3ZF8 GDP 0.009623 0.41451 3.01887
113 3RO7 TDR 0.001268 0.41424 3.01887
114 3HF3 FMN 0.001112 0.40584 3.01887
115 2PNZ UDP 0.001904 0.40505 3.01887
116 3CQD ATP 0.005778 0.40248 3.01887
117 1YOE RIB 0.003105 0.40225 3.01887
118 2BH9 NAP 0.002823 0.40202 3.01887
119 4AG5 ADP 0.02829 0.40166 3.01887
120 1EXB NDP 0.02605 0.40017 3.01887
121 2VBQ BSJ 0.004633 0.40256 3.0303
122 3ZOD FMN 0.002956 0.40008 3.14136
123 3ZOD HQE 0.002956 0.40008 3.14136
124 2F01 BTQ 0.0124 0.41002 3.14961
125 3F8C HT1 0.003098 0.42999 3.1746
126 4DSU BZI 0.01128 0.42099 3.1746
127 1GXU 2HP 0.01372 0.41434 3.2967
128 2BNE U5P 0.002058 0.41448 3.3195
129 2BNF UTP 0.004668 0.40689 3.3195
130 4FFS BIG 0.0002737 0.40707 3.34728
131 1MVN FMN 0.006358 0.40202 3.34928
132 1JN2 SFP 0.0009444 0.50333 3.37553
133 2EB5 OXL 0.0002796 0.4828 3.39623
134 2JFV FLC 0.001016 0.4578 3.39623
135 3WBF API 0.0002134 0.44868 3.39623
136 3WBF NAP 0.0002152 0.44244 3.39623
137 4R33 TRP 0.0003404 0.4415 3.39623
138 4R33 SAH 0.0003404 0.4415 3.39623
139 4CCO OGA 0.001306 0.43987 3.39623
140 1G0N PHH 0.0007493 0.43904 3.39623
141 3BW2 FMN 0.000413 0.43418 3.39623
142 3MPI GRA 0.002017 0.43334 3.39623
143 1F8F NAD 0.002559 0.43021 3.39623
144 4USQ FAD 0.0008195 0.42932 3.39623
145 2Q09 DI6 0.00213 0.42546 3.39623
146 1G0N NDP 0.001599 0.42374 3.39623
147 1OTH PAO 0.001232 0.42041 3.39623
148 3B1F NAD 0.0005267 0.41858 3.39623
149 1KBJ FMN 0.00132 0.41047 3.39623
150 3NYQ AMP 0.003164 0.40724 3.39623
151 3NYQ MCA 0.003117 0.40621 3.39623
152 2ZJ3 G6P 0.000976 0.40572 3.39623
153 4P4T GDP 0.00156 0.40289 3.39623
154 3T1A 5MA 0.001003 0.40155 3.39623
155 2CE7 ADP 0.0003807 0.40075 3.39623
156 3Q3C NAD 0.01444 0.40009 3.39623
157 2DTX BMA 0.0006777 0.43839 3.40909
158 2FR6 CTN 0.0001232 0.44013 3.42466
159 4INB 1F6 0.0004371 0.41719 3.42466
160 4B4D FAD 0.001226 0.40443 3.43511
161 1X1T NAD 0.009393 0.41775 3.46154
162 3OQJ 3CX 0.007669 0.4193 3.50195
163 1VE3 SAM 0.0006657 0.41539 3.52423
164 2JBH 5GP 0.001998 0.42659 3.55556
165 1VQ2 DDN 0.0003212 0.41417 3.62694
166 1EDO NAP 0.01518 0.40835 3.68852
167 4IAE 1DX 0.00114 0.43969 3.7037
168 3EW2 BTN 0.005263 0.40962 3.7037
169 2WCI GSH 0.01503 0.40036 3.7037
170 3SAO DBH 0.00284 0.46046 3.75
171 2IZ1 ATR 0.0001049 0.50179 3.77358
172 1YBH FAD 0.0001892 0.45852 3.77358
173 3ZPG 5GP 0.003779 0.45416 3.77358
174 3F3E LEU 0.0003567 0.44607 3.77358
175 2GWD GLU 0.000829 0.44198 3.77358
176 1UXG FUM 0.000567 0.44003 3.77358
177 1UXG NAD 0.000567 0.44003 3.77358
178 1Z41 FMN 0.0005589 0.42715 3.77358
179 1RP0 AHZ 0.005074 0.4271 3.77358
180 1Z48 FMN 0.0006821 0.42406 3.77358
181 1JA9 NDP 0.00665 0.42248 3.77358
182 1NZY BCA 0.0007684 0.42174 3.77358
183 2CSN CKI 0.0007061 0.41973 3.77358
184 2GDZ NAD 0.001622 0.41347 3.77358
185 2H6T IVA VAL VAL STA ALA STA 0.0003017 0.41341 3.77358
186 1R6D DAU 0.006482 0.41331 3.77358
187 1NHZ 486 0.0002553 0.4132 3.77358
188 1E5F PLP 0.001588 0.41095 3.77358
189 2P8B NSK 0.0341 0.40794 3.77358
190 3U4C NDP 0.002305 0.40674 3.77358
191 2FFC U5P 0.00122 0.4065 3.77358
192 1A27 EST 0.002258 0.40549 3.77358
193 1R6D NAD 0.01104 0.40527 3.77358
194 1GSA GSH 0.007142 0.40316 3.77358
195 3K3K A8S 0.0001774 0.43006 3.79147
196 1L2T ATP 0.001193 0.40854 3.82979
197 1MZV AMP 0.005306 0.40476 3.82979
198 2YGN PCF 0.001285 0.41555 3.84615
199 2Q37 3AL 0.001465 0.44401 3.8674
200 4LSJ LSJ 0.0001983 0.43065 3.87597
201 3HY3 10F 0.0005056 0.42107 3.94089
202 4F4S EFO 0.003218 0.42356 3.94737
203 1QDS PGA 0.004227 0.40862 3.98406
204 1Q0H NDP 0.001535 0.43349 4.15094
205 1Q0H FOM 0.002868 0.42154 4.15094
206 4C6F NCD 0.001976 0.42153 4.15094
207 4C6F DOR 0.001976 0.42153 4.15094
208 4KXV TDP DX5 0.002001 0.42021 4.15094
209 1U5R ATP 0.00106 0.41723 4.15094
210 1RYD GLC 0.01263 0.41539 4.15094
211 2C7G ODP 0.006808 0.41402 4.15094
212 3BRE C2E 0.01428 0.4065 4.15094
213 2C7G FAD 0.01153 0.40599 4.15094
214 4IVG ANP 0.01113 0.40286 4.15094
215 2QCX PF1 0.00126 0.44683 4.18251
216 4OHB 5HM 0.002328 0.40502 4.21053
217 3ICC NAP 0.001513 0.41727 4.31373
218 3W8S GSH 0.01054 0.40704 4.36893
219 3F81 STT 0.002113 0.46684 4.37158
220 1GMN IDS SGN IDS SGN IDS 0.0273 0.40078 4.37158
221 4K30 NLG 0.0006196 0.45336 4.375
222 3QP4 HL0 0.003113 0.4005 4.3956
223 2O66 FLC 0.001442 0.44431 4.44444
224 2Q1A 2KT 0.0003379 0.47914 4.5283
225 2V6O FAD 0.002224 0.44369 4.5283
226 2ZJ5 ADP 0.001715 0.44106 4.5283
227 3GJB AKG 0.001288 0.43427 4.5283
228 4RJK PYR 0.006726 0.43409 4.5283
229 4E28 9MZ 0.003806 0.43221 4.5283
230 2EWM NAD 0.0006041 0.42989 4.5283
231 4AF0 IMP 0.001934 0.42974 4.5283
232 2VDJ HSE 0.008644 0.42883 4.5283
233 4CMF PXG 0.003978 0.41972 4.5283
234 1I7L ATP 0.0006501 0.4174 4.5283
235 4E28 0MZ 0.006311 0.41666 4.5283
236 2CKM AA7 0.004698 0.40983 4.5283
237 3JQ3 ADP 0.004746 0.40666 4.5283
238 4AF0 MOA 0.001648 0.40554 4.5283
239 4QDC ASD 0.002593 0.40278 4.5283
240 1QZZ SAM 0.003513 0.40276 4.5283
241 2QA1 FAD 0.005202 0.40192 4.5283
242 3NFZ 3NF 0.005367 0.40015 4.5283
243 3A2Y TS5 0.001547 0.40708 4.56853
244 1SS4 GSH 0.0001242 0.55515 4.57516
245 1SS4 CIT 0.001304 0.51068 4.57516
246 2QIA U20 0.007445 0.41141 4.58015
247 2Y7P SAL 0.00104 0.44399 4.58716
248 2E0N SAH 0.00001568 0.52245 4.6332
249 3N5O GSH 0.0005875 0.40907 4.68085
250 3BL6 FMC 0.0002593 0.42086 4.78261
251 2W3L DRO 0.01357 0.42621 4.86111
252 1I0Z OXM 0.001528 0.47391 4.90566
253 4W6Z 8ID 0.0001311 0.46039 4.90566
254 3QO8 SSA 0.00003709 0.43804 4.90566
255 4HA6 FAD 0.0009301 0.4377 4.90566
256 1I2B USQ 0.002679 0.42945 4.90566
257 1I2B UPG 0.002679 0.42945 4.90566
258 1I2B NAD 0.002679 0.42945 4.90566
259 4O8A FAD 0.0007894 0.42582 4.90566
260 1TIW TFB 0.00148 0.42495 4.90566
261 1TIW FAD 0.00148 0.42495 4.90566
262 2YPO PHE 0.0009278 0.42193 4.90566
263 2VAR ANP 0.0003888 0.42096 4.90566
264 1FIQ SAL 0.00119 0.42094 4.90566
265 1FIQ MTE 0.0009902 0.42094 4.90566
266 3GTD MLI 0.00619 0.41703 4.90566
267 4OB6 S2T 0.001173 0.41565 4.90566
268 3BAZ NAP 0.0009345 0.41558 4.90566
269 3DAG FEG 0.001218 0.41166 4.90566
270 1NW5 SAM 0.0009313 0.40639 4.90566
271 1WDA BAG 0.00683 0.40504 4.90566
272 1GEX PLP HSA 0.002252 0.40257 4.90566
273 1D6H COA 0.008457 0.40231 4.90566
274 1TUF AZ1 0.002218 0.40117 4.90566
275 1OD6 PNS 0.006117 0.41348 5
276 1MXI SAH 0.001433 0.40414 5
277 4GO7 THR 0.006983 0.40009 5
278 3TA2 AKG 0.0008928 0.42102 5.08475
279 1Y9Q MED 0.004864 0.42745 5.20833
280 1XIU REA 0.0001094 0.44703 5.21739
281 2YCD GTB 0.004 0.40499 5.21739
282 2YC5 6BC 0.000004934 0.50988 5.26316
283 1H8G CHT 0.006533 0.46011 5.26316
284 4LN7 1ZQ 0.002229 0.40157 5.26316
285 4M5P MLA 0.0001109 0.54348 5.28302
286 2XDQ MGX 0.001822 0.47007 5.28302
287 1T10 F6P 0.001092 0.44951 5.28302
288 2C5S AMP 0.002847 0.44525 5.28302
289 1CKM GTP 0.001124 0.43665 5.28302
290 1QY1 PRZ 0.0001763 0.43234 5.28302
291 1U7Z PMT 0.0006808 0.43085 5.28302
292 1LDM NAD 0.005264 0.42391 5.28302
293 2NX1 RP5 0.0007649 0.4218 5.28302
294 2PT9 2MH 0.002156 0.41438 5.28302
295 4M5P 23W 0.01831 0.41305 5.28302
296 2DVZ GLU 0.000091 0.41224 5.28302
297 2C31 TZD 0.01402 0.41142 5.28302
298 3CQ5 PMP 0.005409 0.40913 5.28302
299 3VPD ANP 0.0009496 0.40811 5.28302
300 2NX1 PEP 0.002534 0.40387 5.28302
301 4WB7 ATP 0.004397 0.40127 5.28302
302 1XE7 GUN 0.001989 0.46816 5.41872
303 2Q2V NAD 0.003724 0.40473 5.4902
304 2XCG XCG 0.0004301 0.43356 5.57692
305 4LED XXR 0.03029 0.40239 5.59701
306 3BY8 MLT 0.001593 0.45632 5.6338
307 2B7N NTM 0.0007136 0.45746 5.66038
308 1Z45 NAD 0.0005713 0.42927 5.66038
309 4NM5 ADP 0.0003626 0.42399 5.66038
310 4O1M NAD 0.001017 0.42054 5.66038
311 3CKZ ZMR 0.002946 0.41727 5.66038
312 1SNY NAP 0.002177 0.40464 5.66038
313 4TSK NDP 0.01084 0.40772 5.71429
314 2E2R 2OH 0.0005587 0.43524 5.7377
315 4PTZ FMN 0.0007377 0.41825 5.75916
316 1JCM 137 0.003087 0.40234 5.79151
317 3RF4 FUN 0.0001045 0.48553 6.03448
318 4OYA 1VE 0.00575 0.43755 6.03774
319 1GJW GLC 0.008288 0.42312 6.03774
320 3LTW HLZ 0.01107 0.42214 6.03774
321 1GJW MAL 0.002013 0.42122 6.03774
322 1V6A TRE 0.005925 0.41785 6.03774
323 4GYW UDP 0.002368 0.41041 6.03774
324 1P4C FMN 0.01996 0.40251 6.03774
325 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.007061 0.40237 6.03774
326 1PX8 XYP 0.01445 0.40111 6.03774
327 3UST FAD 0.0005444 0.4006 6.03774
328 2P8O BVA 0.0006855 0.40343 6.10687
329 1XX4 BAM 0.00359 0.45528 6.13027
330 4B8V NDG NAG NAG NAG 0.0006538 0.42254 6.14035
331 3JDW ORN 0.0003103 0.40982 6.14657
332 2WMO GTP 0.001415 0.41729 6.31579
333 2OFE NAG 0.001222 0.45422 6.33803
334 2OG2 MLI 0.0007819 0.50981 6.41509
335 3B9Q MLI 0.002778 0.46985 6.41509
336 1R37 NAD 0.0001514 0.45539 6.41509
337 1XHL NDP 0.0001428 0.45336 6.41509
338 1ZK7 FAD 0.0009832 0.43881 6.41509
339 1I9G SAM 0.001203 0.43556 6.41509
340 4PLG OXM 0.0007348 0.43477 6.41509
341 4PLG NAI 0.0007348 0.43477 6.41509
342 3TKA CTN 0.01882 0.42329 6.41509
343 4KCF AKM 0.0004874 0.42161 6.41509
344 1RZM PEP 0.004502 0.41748 6.41509
345 3OIG IMJ 0.00175 0.41634 6.41509
346 2Q28 ADP 0.0007603 0.40928 6.41509
347 3TKA SAM 0.0006995 0.40468 6.41509
348 3E7S AT2 0.0243 0.40322 6.41509
349 1LC8 33P 0.002796 0.4009 6.41509
350 2IYG FMN 0.0003821 0.44363 6.45161
351 3NCQ ATP 0.0002405 0.42787 6.72269
352 3E5H GNP 0.0001547 0.40962 6.74157
353 3PLN U5P 0.00184 0.43367 6.79245
354 3NKS ACJ 0.000165 0.41873 6.79245
355 3NKS FAD 0.002806 0.4138 6.79245
356 3H0L ADP 0.01758 0.40581 6.79245
357 2PR5 FMN 0.00004375 0.45531 6.81818
358 4EXO PYR 0.0001198 0.51834 6.84932
359 3CH5 GDP 0.002041 0.41607 6.94444
360 1TU3 GNP 0.0001715 0.44065 7.01754
361 2XK9 XK9 0.0001991 0.45116 7.16981
362 3QV9 QV7 0.004732 0.42206 7.16981
363 1DLJ UGA 0.003723 0.4208 7.16981
364 1Q11 TYE 0.004268 0.41845 7.16981
365 1DLJ NAI 0.00941 0.40562 7.16981
366 1U3G THF 0.00787 0.40004 7.16981
367 2FEQ 34P 0.001872 0.4042 7.33591
368 2XG5 EC5 0.01102 0.41673 7.33945
369 2C2A ADP 0.001291 0.40981 7.36434
370 1JH7 UVC 0.0008572 0.45403 7.40741
371 2GJ3 FAD 0.0003249 0.43857 7.5
372 1L1Q 9DA 0.0006875 0.41072 7.52688
373 1QPB PYM 0.0001837 0.44143 7.54717
374 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.001422 0.43609 7.54717
375 2Q8M AMP 0.00007365 0.41835 7.54717
376 1QPB TPP 0.0009229 0.41741 7.54717
377 4BG1 IVL 0.0003802 0.41321 7.54717
378 4BG1 OGA 0.0003802 0.41321 7.54717
379 2YKL NLD 0.01248 0.40502 7.54717
380 3KMT SAH 0.0004345 0.43614 7.56302
381 4BMO FMN 0.0002686 0.43402 7.56302
382 3D2Y AH0 ALA FGA LYS 0.0005982 0.41696 7.66284
383 3QDY A2G GAL 0.005826 0.43711 7.69231
384 3QDT A2G GAL 0.007 0.43326 7.69231
385 3QDY CBS 0.007186 0.42599 7.69231
386 2XD9 XD9 0.04628 0.40964 7.78443
387 3Q9T FAY 0.001063 0.43016 7.92453
388 2DKH FAD 0.001537 0.41833 7.92453
389 2DKH 3HB 0.002416 0.41833 7.92453
390 3A2Q ACA ACA 0.0007706 0.40273 7.92453
391 2HGS GSH 0.0003211 0.40266 7.92453
392 1LTH NAD 0.01317 0.40162 7.92453
393 1ULE GLA GAL NAG 0.001398 0.46698 8
394 2E1A MSE 0.003921 0.41477 8
395 1RYI GOA 0.0008514 0.43912 8.30189
396 1RYI FAD 0.001142 0.43234 8.30189
397 4N02 FNR 0.004249 0.42027 8.30189
398 2NLI FMN 0.006221 0.4124 8.30189
399 2NLI LAC 0.006221 0.4124 8.30189
400 3DER ALA LYS 0.0005996 0.40721 8.30189
401 4K5S PM0 0.009834 0.4041 8.30189
402 2EJU SAH 0.001633 0.40223 8.30189
403 3W54 RNB 0.0004945 0.40092 8.30189
404 3SJ0 DXC 0.01122 0.417 8.4507
405 2X61 CH 0.002526 0.41763 8.52713
406 2X61 NGA GAL SIA 0.01631 0.40088 8.52713
407 4NVP 7CH 0.00313 0.40981 8.61244
408 1LNX URI 0.003729 0.4209 8.64198
409 1T0S BML 0.004805 0.44114 8.67924
410 1E4E PHY 0.0003151 0.43604 8.67924
411 1E4E ADP 0.0002117 0.43219 8.67924
412 1N6B DMZ 0.002378 0.41639 8.67924
413 3I0O ADP 0.002817 0.41551 8.67924
414 3C1O NAP 0.001407 0.40786 8.67924
415 1OFH ADP 0.01391 0.40423 8.67924
416 1BDB NAD 0.02236 0.40281 8.67924
417 3I0O SMI 0.01397 0.40174 8.67924
418 2V7T SAH 0.0007256 0.47017 8.69565
419 2ALG DAO 0.0000641 0.44689 8.69565
420 2ALG HP6 0.0000641 0.44689 8.69565
421 5RHN 8BR 0.003079 0.40068 8.69565
422 2HNK SAH 0.001101 0.40399 8.78661
423 1GT4 UNA 0.00449 0.41782 8.80503
424 1BGQ RDC 0.0001086 0.44924 8.88889
425 4LKK SIA GAL 0.001007 0.40931 8.92857
426 2Q8H TF4 0.0003248 0.50765 9.0566
427 1H2B NAJ 0.0006965 0.4305 9.0566
428 1I2L DCS 0.0001745 0.43029 9.0566
429 2O2C G6Q 0.0007801 0.42198 9.0566
430 4G1V FAD 0.001483 0.41189 9.0566
431 1B8U OAA 0.003269 0.40548 9.0566
432 1YRX FMN 0.001502 0.41181 9.09091
433 3BHO B4P 0.02389 0.42088 9.13461
434 2ZSC BTN 0.002898 0.40584 9.21986
435 1F5F DHT 0.00001889 0.4735 9.26829
436 3R35 4CO 0.0002763 0.44179 9.27152
437 3GEG NAD 0.0004976 0.42824 9.31174
438 1QD0 RR6 0.001634 0.41973 9.375
439 1T0I FMN 0.0005449 0.40994 9.42408
440 1F1V DHY 0.0008492 0.44156 9.43396
441 4M51 BEZ 0.007455 0.43194 9.43396
442 2QV7 ADP 0.0004112 0.43191 9.43396
443 2QS8 MET 0.0008108 0.42247 9.43396
444 1C0I BE2 0.006579 0.40813 9.43396
445 1C0I FAD 0.006579 0.40813 9.43396
446 1T57 FMN 0.001263 0.40589 9.43396
447 1KYQ NAD 0.001581 0.4027 9.43396
448 1QJC PNS 0.0122 0.40324 9.49367
449 3PVT 3HC 0.001908 0.41984 9.65251
450 1UH4 GLC 0.0004476 0.49264 9.81132
451 2PTZ PAH 0.0005188 0.40127 9.81132
452 4P3H 25G 0.008799 0.40256 9.84456
453 1Y75 NAG 0.003278 0.41791 10.1695
454 1WRA PC 0.0001852 0.49959 10.1887
455 1SOW NAD 0.0003173 0.44116 10.566
456 2BLE 5GP 0.002444 0.43403 10.566
457 4C0C WVH 0.002633 0.42199 10.566
458 4KQI RBZ 0.001182 0.41967 10.566
459 4KQI NIO 0.001182 0.41967 10.566
460 1NVU GTP 0.005121 0.41873 10.566
461 1ZS6 ADP 0.002959 0.41971 10.6509
462 1KDK DHT 0.0003362 0.42508 10.7345
463 3CF6 SP1 0.00008849 0.45573 10.7784
464 2HVW DDN 0.00008155 0.42352 10.8696
465 1Y1A GSH 0.0006769 0.5192 10.929
466 2F2U M77 0.0001033 0.47156 10.9434
467 1PEA ACM 0.002892 0.45177 10.9434
468 4KCT PYR 0.0006427 0.44643 10.9434
469 1QO0 BMD 0.00226 0.44232 10.9434
470 4KCT FDP 0.001852 0.41767 10.9434
471 1C1X HFA 0.007841 0.41461 10.9434
472 3K37 BCZ 0.01708 0.40963 10.9434
473 1BW9 PPY 0.009871 0.40599 10.9434
474 3S9K CIT 0.005823 0.45821 11.0169
475 2VKL MLT 0.01804 0.42734 11.1111
476 1MDZ DCS 0.001956 0.41463 11.3208
477 3LZW NAP 0.00791 0.41368 11.3208
478 1MDZ PLP 0.002239 0.41127 11.3208
479 3LZW FAD 0.00567 0.40383 11.3208
480 4BAS GNP 0.0004437 0.41906 11.5578
481 2IXB A2G 0.00255 0.4164 11.6981
482 2IXB NAD 0.001465 0.4164 11.6981
483 4JP3 CIT 0.0004585 0.44063 11.7155
484 1UO5 PIH 0.004887 0.46707 11.7647
485 1UO4 PIH 0.005528 0.45441 11.7647
486 3R51 MMA 0.0006966 0.49103 11.875
487 4GLJ RHB 0.0007897 0.42721 12.0755
488 2NVK NAP 0.004016 0.41955 12.0755
489 1Y7P RIP 0.02433 0.40607 12.1076
490 1NU4 MLA 0.02478 0.42003 12.3711
491 4F8L GAL 0.006881 0.45887 12.4138
492 3KJQ B94 0.001959 0.41675 12.6316
493 1SC3 MLI 0.0002818 0.50046 12.9213
494 3CBC DBS 0.02444 0.40968 13.1313
495 4JCA CIT 0.000528 0.50795 13.1737
496 3GE7 AFQ 0.000785 0.42867 13.2075
497 2YLD CMO 0.0005638 0.46922 13.3858
498 1V35 NAI 0.001515 0.42784 13.5849
499 2FOI JPA 0.0055 0.40415 13.5849
500 1DSS NAD 0.002062 0.40387 13.5849
501 1N9L FMN 0.00006671 0.44913 13.7615
502 4NAO AKG 0.00174 0.45454 13.9623
503 2J8Z NAP 0.0003501 0.43512 13.9623
504 2FYU FDN 0.0004467 0.42124 14.1026
505 1TH8 ADP 0.006389 0.40161 14.6552
506 2AWN ADP 0.01148 0.42695 14.717
507 3DDC GNP 0.0002568 0.43468 14.7239
508 2QF7 COA 0.002554 0.40786 15.0943
509 2H6B 3C4 0.001555 0.43845 15.2
510 1OGD RIP 0.001658 0.43556 15.2672
511 4COQ SAN 0.0005826 0.46858 15.3846
512 1EYE PMM 0.0005163 0.43868 15.4717
513 3M0J OAF 0.003078 0.4051 15.4717
514 1Y2W NAG 0.0001647 0.49305 15.493
515 1ZJ6 G3D 0.001946 0.41686 16.0428
516 1C1L GAL BGC 0.004154 0.43704 16.0584
517 1ECM TSA 0.001041 0.43799 16.5138
518 3ZZS TRP 0.0004852 0.43873 16.9231
519 4EKV BTN 0.00398 0.4037 16.9811
520 4NAT ADP 0.005338 0.43198 17.5
521 3GM5 CIT 0.0006577 0.46623 17.6101
522 2YBQ SAH 0.000004702 0.53295 18.4906
523 1JIL 485 0.0002604 0.42458 18.4906
524 2YBQ UP2 0.00001731 0.41925 18.4906
525 1JUV NDP 0.001571 0.40949 18.6528
526 2A0W DIH 0.003262 0.40738 19.2453
527 1PJS SAH 0.000002027 0.5484 20
528 2YYJ FAD 0.01904 0.40977 20.3774
529 2YYJ 4HP 0.01904 0.40977 20.3774
530 3SIX GDP 0.002132 0.41535 21.5094
531 5HW4 SAM 0.009442 0.41746 22.9839
532 1V9A SAH 0.000005737 0.54841 24.6862
533 3PNA CMP 0.0000729 0.40609 25.974
534 2QBU SAH 0.000003316 0.54564 28.0172
535 4CO3 ATP 0.006734 0.4041 32.1429
536 2V5E SCR 0.01325 0.43442 32.6733
537 1UKW FAD 0.004987 0.40479 35.4717
538 1CBF SAH 0.0000234 0.48503 36.2264
539 1BTN I3P 0.0001324 0.56324 36.7925
540 2HV8 GTP 0.0002126 0.43563 45.3125
Pocket No.: 2; Query (leader) PDB : 1WNG; Ligand: SAH; Similar sites found: 12
This union binding pocket(no: 2) in the query (biounit: 1wng.bio1) has 22 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4PPF FLC 0.03329 0.4019 1.50943
2 5D9G GLU ASN LEU TYR PHE GLN 0.003069 0.44363 1.62602
3 4KBA 1QM 0.006675 0.42682 3.01887
4 3KRR DQX 0.02975 0.4079 3.39623
5 4XWM CBI 0.01861 0.40864 4.90566
6 5BVE 4VG 0.03718 0.40195 5.66038
7 5O4F 8VE 0.01655 0.40711 5.81395
8 5UDS ATP 0.01762 0.40169 6.03774
9 4X6F 3XU 0.01932 0.40147 6.79245
10 5L2J 6UL 0.008848 0.4347 7.14286
11 5L2J 70E 0.009399 0.4347 7.14286
12 2XG5 EC2 0.01102 0.41673 7.33945
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