Receptor
PDB id Resolution Class Description Source Keywords
3AJR 1.77 Å EC: 1.1.1.103 CRYSTAL STRUCTURE OF L-3-HYDROXYNORVALINE BOUND L-THREONINE DEHYDROGENASE (Y137F) FROM HYPERTHERMOPHILIC ARCHAEON THERMV OLCANIUM THERMOPLASMA VOLCANIUM L-THREONINE DEHYDROGENASE THERMOPLASMA VOLCANIUM L-3- HYDROXYNORVALINE OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF BINARY AND TERNARY COMPLEXES O ARCHAEAL UDP-GALACTOSE 4-EPIMERASE-LIKE L-THREONINE DEHYDROGENASE FROM THERMOPLASMA VOLCANIUM. J.BIOL.CHEM. V. 287 12966 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MPD A:5276;
B:5277;
Invalid;
Invalid;
none;
none;
submit data
118.174 C6 H14 O2 C[C@@...
NAD A:3001;
B:3002;
Valid;
Valid;
none;
none;
submit data
663.425 C21 H27 N7 O14 P2 c1cc(...
VAH A:318;
B:318;
Valid;
Valid;
none;
none;
submit data
133.146 C5 H11 N O3 CC[C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3A4V 1.78 Å EC: 1.1.1.103 CRYSTAL STRUCTURE OF PYRUVATE BOUND L-THREONINE DEHYDROGENAS HYPERTHERMOPHILIC ARCHAEON THERMOPLASMA VOLCANIUM THERMOPLASMA VOLCANIUM L-THREONINE DEHYDROGENASE PYRUVATE OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF BINARY AND TERNARY COMPLEXES O ARCHAEAL UDP-GALACTOSE 4-EPIMERASE-LIKE L-THREONINE DEHYDROGENASE FROM THERMOPLASMA VOLCANIUM. J.BIOL.CHEM. V. 287 12966 2012
Members (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 3A4V Ki = 23.2 mM PYR C3 H4 O3 CC(=O)C(=O....
2 3A1N - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
3 3A9W - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 3AJR - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3A4V Ki = 23.2 mM PYR C3 H4 O3 CC(=O)C(=O....
2 3A1N - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
3 3A9W - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 3AJR - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 177 families.
1 3WMX - THR C4 H9 N O3 C[C@H]([C@....
2 3A4V Ki = 23.2 mM PYR C3 H4 O3 CC(=O)C(=O....
3 3A1N - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 3A9W - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
5 3AJR - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
6 2YY7 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAD; Similar ligands found: 220
No: Ligand ECFP6 Tc MDL keys Tc
1 A3D 0.872727 0.986111
2 NAD IBO 0.845455 0.933333
3 NHD 0.821429 0.972222
4 NAP 0.811966 0.986111
5 NAJ PYZ 0.803419 0.910256
6 NFD 0.791304 0.946667
7 NXX 0.765766 0.972603
8 DND 0.765766 0.972603
9 ZID 0.737705 0.986111
10 NAQ 0.729508 0.934211
11 NAE 0.721311 0.959459
12 NA0 0.712 0.972603
13 TAP 0.704 0.921053
14 AMP NAD 0.696 0.945946
15 NDE 0.689922 0.972603
16 NAJ 0.683333 0.972222
17 NDC 0.679389 0.934211
18 NDO 0.674603 0.958904
19 N01 0.656 0.972222
20 CNA 0.642276 0.972603
21 NBP 0.621212 0.922078
22 NAD BBN 0.609929 0.876543
23 8ID 0.609756 0.922078
24 NAD CJ3 0.601399 0.845238
25 ADP MG 0.579439 0.918919
26 A2D 0.576923 0.958333
27 ADP 0.575472 0.931507
28 NGD 0.574803 0.922078
29 BEF ADP 0.574074 0.894737
30 ADP BEF 0.574074 0.894737
31 BA3 0.566038 0.958333
32 NAD NDT 0.565789 0.755319
33 M33 0.564815 0.918919
34 ADP PO3 0.563636 0.957747
35 B4P 0.560748 0.958333
36 AP5 0.560748 0.958333
37 ATP MG 0.558559 0.918919
38 AN2 0.555556 0.918919
39 GAP 0.553571 0.932432
40 OOB 0.551724 0.972222
41 CA0 0.550459 0.932432
42 ATP 0.545455 0.931507
43 ACP 0.545455 0.906667
44 NAD TDB 0.544872 0.70297
45 ADP ALF 0.54386 0.883117
46 ALF ADP 0.54386 0.883117
47 5FA 0.540541 0.931507
48 AQP 0.540541 0.931507
49 APR 0.540541 0.931507
50 AR6 0.540541 0.931507
51 ANP MG 0.53913 0.907895
52 VO4 ADP 0.53913 0.945205
53 ADP VO4 0.53913 0.945205
54 AGS 0.535714 0.883117
55 SAP 0.535714 0.883117
56 AD9 0.535714 0.906667
57 WAQ 0.533333 0.896104
58 ABM 0.53271 0.905405
59 00A 0.529412 0.921053
60 DLL 0.529412 0.972222
61 ANP 0.526316 0.906667
62 NJP 0.526316 0.959459
63 ACQ 0.526316 0.906667
64 OAD 0.525 0.932432
65 AMP MG 0.523364 0.905405
66 ADX 0.522523 0.839506
67 5AL 0.521739 0.945205
68 A1R 0.521008 0.871795
69 9SN 0.520325 0.909091
70 AMP 0.518868 0.930556
71 A 0.518868 0.930556
72 50T 0.517857 0.893333
73 ATF 0.517241 0.894737
74 DAL AMP 0.516949 0.945205
75 3OD 0.516393 0.932432
76 1ZZ 0.516393 0.851852
77 SON 0.513514 0.92
78 PRX 0.513274 0.881579
79 SRP 0.512821 0.92
80 ADP BMA 0.512397 0.932432
81 3UK 0.512397 0.958904
82 MYR AMP 0.512195 0.851852
83 NAJ PZO 0.510949 0.909091
84 NMN 0.509434 0.875
85 AMP DBH 0.507937 0.906667
86 A22 0.504202 0.945205
87 FA5 0.504 0.945946
88 ATP A A A 0.504 0.971831
89 TYR AMP 0.5 0.945946
90 8QN 0.5 0.945205
91 NAX 0.496183 0.886076
92 PR8 0.495935 0.8625
93 PAJ 0.495868 0.873418
94 4AD 0.495868 0.933333
95 AMO 0.495868 0.92
96 ADQ 0.495868 0.932432
97 A12 0.495495 0.894737
98 AP2 0.495495 0.894737
99 ALF ADP 3PG 0.492424 0.873418
100 LA8 ALF 3PG 0.492424 0.873418
101 AHZ 0.492308 0.851852
102 YAP 0.492063 0.933333
103 FYA 0.491935 0.918919
104 AHX 0.491803 0.884615
105 4UU 0.488372 0.933333
106 5SV 0.487603 0.8375
107 TAT 0.487179 0.894737
108 APC 0.486957 0.894737
109 SRA 0.486239 0.881579
110 NAI 0.484848 0.921053
111 6V0 0.484848 0.909091
112 GTA 0.484615 0.898734
113 A A 0.483871 0.958333
114 LAD 0.483871 0.873418
115 AU1 0.482456 0.906667
116 TXE 0.481203 0.921053
117 AF3 ADP 3PG 0.481203 0.873418
118 OMR 0.481203 0.841463
119 LAQ 0.480916 0.851852
120 G3A 0.48062 0.909091
121 TXA 0.48 0.92
122 NB8 0.48 0.884615
123 ME8 0.48 0.851852
124 BIS 0.48 0.871795
125 PTJ 0.48 0.884615
126 139 0.477941 0.886076
127 LPA AMP 0.477273 0.851852
128 AR6 AR6 0.476923 0.958333
129 G5P 0.476923 0.909091
130 AFH 0.476923 0.873418
131 25L 0.47619 0.945205
132 25A 0.47541 0.958333
133 DZD 0.47482 0.897436
134 TXD 0.473684 0.921053
135 4UV 0.472868 0.933333
136 TYM 0.470149 0.945946
137 ADV 0.470085 0.894737
138 RBY 0.470085 0.894737
139 ARG AMP 0.469697 0.841463
140 4TA 0.467626 0.864198
141 48N 0.466165 0.884615
142 XAH 0.465116 0.851852
143 4UW 0.462687 0.897436
144 M24 0.461538 0.886076
145 IOT 0.459854 0.821429
146 T5A 0.456522 0.853659
147 EAD 0.455782 0.886076
148 MAP 0.455285 0.883117
149 BT5 0.453901 0.821429
150 A4P 0.452555 0.833333
151 UP5 0.451852 0.933333
152 PAP 0.445378 0.917808
153 AP0 0.445255 0.884615
154 4TC 0.445255 0.909091
155 YLP 0.444444 0.831325
156 P1H 0.443709 0.864198
157 AOC 0.442478 0.810811
158 Z5A 0.439189 0.833333
159 2A5 0.436975 0.857143
160 G A A A 0.43662 0.909091
161 COD 0.43662 0.802326
162 ADJ 0.435714 0.841463
163 YLC 0.434783 0.851852
164 YLB 0.434783 0.831325
165 U A G G 0.433566 0.921053
166 ATR 0.433333 0.90411
167 7MD 0.432836 0.851852
168 G5A 0.429752 0.790698
169 PO4 PO4 A A A A PO4 0.429688 0.943662
170 TAD 0.42963 0.873418
171 5AS 0.42735 0.770115
172 BTX 0.426573 0.831325
173 YLA 0.425532 0.831325
174 DSZ 0.425197 0.790698
175 NCN 0.424779 0.805556
176 UPA 0.42446 0.921053
177 VMS 0.424 0.8
178 54H 0.424 0.8
179 N0B 0.422819 0.853659
180 6AD 0.422764 0.85
181 AYB 0.422535 0.821429
182 7D3 0.422414 0.844156
183 YLY 0.421769 0.821429
184 TSB 0.420635 0.809524
185 ODP 0.41958 0.922078
186 AV2 0.419355 0.855263
187 FB0 0.419355 0.775281
188 A5A 0.419355 0.819277
189 NNR 0.419048 0.739726
190 A A A 0.418605 0.918919
191 LEU LMS 0.418605 0.793103
192 649 0.417266 0.775281
193 NMN AMP PO4 0.416667 0.933333
194 SSA 0.416 0.790698
195 P5A 0.415385 0.755556
196 LSS 0.414062 0.772727
197 A2R 0.412698 0.918919
198 52H 0.412698 0.790698
199 JB6 0.412214 0.896104
200 5N5 0.411215 0.783784
201 YSA 0.410448 0.811765
202 5CA 0.409449 0.790698
203 53H 0.409449 0.790698
204 ITT 0.408333 0.878378
205 7D4 0.408333 0.844156
206 NA7 0.407692 0.894737
207 5CD 0.407407 0.794521
208 0WD 0.406897 0.909091
209 A3P 0.40678 0.930556
210 AVV 0.40625 0.860759
211 RAB 0.40566 0.808219
212 ADN 0.40566 0.808219
213 XYA 0.40566 0.808219
214 FDA 0.405063 0.823529
215 GSU 0.40458 0.790698
216 7MC 0.404255 0.831325
217 NSS 0.403101 0.811765
218 6FA 0.402516 0.853659
219 NVA LMS 0.4 0.793103
220 PPS 0.4 0.817073
Ligand no: 2; Ligand: VAH; Similar ligands found: 8
No: Ligand ECFP6 Tc MDL keys Tc
1 VAH 1 1
2 THR 0.541667 0.76
3 ILE 0.538462 0.703704
4 DBB 0.5 0.730769
5 ABA 0.5 0.730769
6 ALA 0.434783 0.6
7 DAL 0.434783 0.6
8 NVA 0.428571 0.714286
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3A4V; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 3a4v.bio1) has 37 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3A4V; Ligand: PYR; 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: 3a4v.bio1) has 36 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3A4V; Ligand: NAD; Similar sites found: 437
This union binding pocket(no: 3) in the query (biounit: 3a4v.bio1) has 38 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1AE1 NAP 0.0000001854 0.5332 1.0989
2 1V35 NAI 0.000001766 0.51733 1.57729
3 1T26 NAI 0.00004672 0.46743 1.57729
4 1BW9 NAD 0.0007185 0.45659 1.57729
5 1C1X NAD 0.0006069 0.44572 1.57729
6 2A92 NAI 0.0001681 0.42794 1.57729
7 1HKU NAD 0.00192 0.41451 1.57729
8 4RDH AMP 0.008698 0.42538 1.73611
9 3U4C NDP 0.00001719 0.4526 1.77936
10 1CER NAD 0.0002525 0.46119 1.89274
11 3B1J NAD 0.0006985 0.43408 1.89274
12 3CIF NAD 0.0005449 0.40551 1.89274
13 2B4R NAD 0.0007271 0.40514 1.89274
14 5JJR SAH 0.01982 0.40186 1.89274
15 4NEC SAH 0.001844 0.45786 1.89394
16 3VPH NAD 0.0003416 0.43721 1.93548
17 3VPH OXM 0.0002583 0.43606 1.93548
18 2P41 SAH 0.005165 0.42898 1.96721
19 3WBF NAP 0.001548 0.42345 1.96721
20 4FN4 NAD 0.00000001114 0.61946 1.9685
21 2EWM NAD 0.000000003752 0.63163 2.00803
22 4OHU NAD 0.000009041 0.50713 2.07612
23 4OHU 2TK 0.000009041 0.50713 2.07612
24 2F1K NAP 0.0007124 0.44289 2.15054
25 2RH4 EMO 0.00000003197 0.51923 2.16606
26 2B4Q NAP 0.00000008745 0.53231 2.17391
27 2V6G NAP 0.000001337 0.49671 2.2082
28 1HDG NAD 0.0007296 0.44573 2.2082
29 1U1I NAD 0.0001349 0.43761 2.2082
30 5MQ6 NDP 0.003513 0.42339 2.2082
31 5DN9 NAD 0.0006113 0.41308 2.2082
32 4KBA 1QM 0.03089 0.41239 2.2082
33 4UP4 GAL NAG 0.04238 0.40779 2.2082
34 1OBB NAD 0.008157 0.40497 2.2082
35 1DLJ NAI 0.004484 0.40209 2.2082
36 1DLJ UGA 0.004658 0.40148 2.2082
37 5GT9 NAP 0.000001711 0.49354 2.28137
38 1GEE NAD 0.000000009192 0.62268 2.29885
39 1NFQ NAI 0.0000000002262 0.62501 2.30769
40 4OBW SAM 0.009981 0.41572 2.33463
41 2WSB NAD 0.000000005051 0.60695 2.3622
42 2DT5 NAD 0.0009359 0.43204 2.36967
43 5U5G NAP 0.0005228 0.4045 2.37288
44 1ZK4 NAP 0.0000001187 0.55092 2.39044
45 1ZK4 AC0 0.01271 0.42718 2.39044
46 2CFC NAD 0.000000003978 0.64302 2.4
47 3ZV6 4HB 0.00000002524 0.58533 2.4911
48 3ZV6 NAD 0.00000002267 0.58533 2.4911
49 1I2B NAD 0.000000007342 0.62166 2.52366
50 1I2B USQ 0.0003544 0.47948 2.52366
51 1I2B UPG 0.0003544 0.47948 2.52366
52 4KOA NDP 0.009119 0.42088 2.52366
53 3G5S FAD 0.001466 0.40797 2.52366
54 1Z82 NDP 0.006443 0.4015 2.52366
55 4RSL FAD 0.002098 0.40131 2.52366
56 1BDB NAD 0.00000002717 0.5883 2.52708
57 1IY8 NAD 0.0000000004425 0.61075 2.62172
58 1VPD TLA 0.01911 0.42305 2.67559
59 2PV7 NAD 0.0005394 0.44457 2.68456
60 3TN7 NJP 0.00000001788 0.55844 2.72374
61 3RJ5 NAD 0.00000002214 0.56381 2.75591
62 1V6A TRE 0.00004405 0.57412 2.83912
63 1I0Z NAI 0.00001308 0.50084 2.83912
64 9LDB NAD 0.00003101 0.45033 2.83912
65 9LDT NAD 0.00003738 0.44767 2.83912
66 5T9E NAP 0.0000739 0.42593 2.83912
67 1O0S NAI 0.01146 0.40134 2.83912
68 4GK9 MAN BMA MAN MAN MAN 0.04565 0.415 2.86738
69 2BKA NDP 0.000003574 0.47422 2.89256
70 2CUL FAD 0.001189 0.40752 3.01724
71 1X1T NAD 0.0000004913 0.54196 3.07692
72 3JQA NAP 0.0000006685 0.56064 3.125
73 3JQG NAP 0.0000007867 0.55782 3.125
74 3JQB NAP 0.0000008494 0.55649 3.125
75 3BMO NAP 0.0000007645 0.55332 3.125
76 3JQF NAP 0.0000006102 0.55227 3.125
77 4CM4 NAP 0.0000008626 0.55126 3.125
78 5JCJ NAP 0.0000008886 0.55076 3.125
79 3BMQ NAP 0.0000006693 0.55072 3.125
80 4CMI NAP 0.000001004 0.54867 3.125
81 5K6A NAP 0.0000007969 0.49871 3.125
82 3JQ9 NAP 0.0000008452 0.49796 3.125
83 4CLR NAP 0.0000006235 0.49733 3.125
84 4CME NAP 0.0000006724 0.49679 3.125
85 4CLO NAP 0.0000004979 0.49624 3.125
86 4CM9 NAP 0.000001011 0.4953 3.125
87 4CM8 NAP 0.0000007851 0.49415 3.125
88 3JQ8 NAP 0.00000117 0.4935 3.125
89 3BMN NAP 0.0000012 0.49283 3.125
90 5JDI NAP 0.0000008924 0.49273 3.125
91 5JDC NAP 0.0000009389 0.49246 3.125
92 3JQ7 NAP 0.000001325 0.48251 3.125
93 5JCJ 6JM 0.01253 0.43778 3.125
94 3JQF AX2 0.02744 0.41957 3.125
95 2HJR APR 0.000001839 0.56386 3.15457
96 5L53 NAP 0.00000001457 0.51107 3.15457
97 1A5Z NAD 0.00005058 0.50683 3.15457
98 3TLJ SAH 0.003807 0.4219 3.15457
99 1G55 SAH 0.006636 0.42063 3.15457
100 4XB2 HSE 0.000416 0.41538 3.15457
101 4XB2 NDP 0.000105 0.40903 3.15457
102 2Z3Y F2N 0.00315 0.40238 3.15457
103 1SAY PYR 0.001501 0.40204 3.15457
104 3I8P 840 0.02901 0.4 3.15457
105 3GGO NAI 0.00006025 0.46222 3.18471
106 3GGO ENO 0.00006025 0.46222 3.18471
107 3DXY SAM 0.008554 0.4334 3.21101
108 1XS5 MET 0.04244 0.40881 3.3195
109 2VZ0 D64 0.000007777 0.52576 3.35821
110 2VZ0 NAP 0.000007777 0.52576 3.35821
111 2WD7 NAP 0.0000007596 0.49464 3.35821
112 2WYV NAD 0.000005403 0.4731 3.44828
113 1UY4 XYP XYP XYP XYP 0.04128 0.41337 3.44828
114 3V1U NAD 0.000000001176 0.567 3.47003
115 1E7S NAP 0.00000002965 0.55634 3.47003
116 3OA2 NAD 0.0002697 0.45326 3.47003
117 3I6I NDP 0.00008317 0.44232 3.47003
118 4OPC PGT 0.01679 0.40552 3.47003
119 3DMH SAM 0.0123 0.4055 3.47003
120 2EG5 SAH 0.03099 0.40505 3.47003
121 2IXB NAD 0.003593 0.40414 3.47003
122 1J49 NAD 0.0004626 0.40401 3.47003
123 4OPC FDA 0.0172 0.40223 3.47003
124 3G89 SAM 0.005487 0.43897 3.61446
125 2VDV SAM 0.001661 0.46452 3.65854
126 5THQ NDP 0.00000001547 0.55548 3.67647
127 3OFK SAH 0.00611 0.4291 3.7037
128 3AY6 NAI 0.00000008303 0.55018 3.71747
129 3AY6 BGC 0.000000265 0.47622 3.71747
130 2GC0 PAN 0.02087 0.40381 3.7234
131 1SNY NAP 0.000000415 0.49791 3.74532
132 4MDH NAD 0.00002399 0.49855 3.78549
133 4PLG NAI 0.0000566 0.45798 3.78549
134 5MDH NAD 0.00001034 0.45087 3.78549
135 5VN0 NAI 0.00322 0.41627 3.78549
136 1H82 GZZ 0.003448 0.41395 3.78549
137 1H82 FAD 0.003159 0.41173 3.78549
138 1H2B NAJ 0.001874 0.40996 3.78549
139 4R5M NAP 0.003636 0.40886 3.78549
140 5M67 ADE 0.003783 0.40398 3.78549
141 4ZGS NAD 0.0002402 0.40388 3.78549
142 5M67 NAD 0.004156 0.40247 3.78549
143 5M67 3D1 0.004534 0.40108 3.78549
144 3H4V DVP 0.000001164 0.5253 3.81944
145 3H4V NAP 0.000002383 0.51265 3.81944
146 1DCP HBI 0.03455 0.411 3.84615
147 5XVQ SAH 0.001777 0.43607 3.87324
148 1UXG NAD 0.00007871 0.45425 3.8835
149 1HYH NAD 0.0003143 0.44441 3.8835
150 3VYW SAM 0.007059 0.41627 3.8961
151 2DKN NAI 0.00000004588 0.60131 3.92157
152 2GUE NAG 0.01491 0.41421 4.09836
153 3HB5 NAP 0.00000001261 0.51606 4.10095
154 3ABI NAD 0.000006244 0.51325 4.10095
155 1VKO NAD 0.00004361 0.47355 4.10095
156 2JJQ SAH 0.007227 0.43307 4.10095
157 2GSD NAD 0.0008486 0.41275 4.10095
158 3OIG NAD 0.000002711 0.47526 4.13534
159 4GKV NAD 0.00032 0.42437 4.16667
160 2Q0L NAP 0.01873 0.40925 4.18006
161 4OSP NAP 0.0000002117 0.51426 4.18251
162 4CS9 AMP 0.02114 0.42851 4.2328
163 4J4H 1J1 0.001099 0.42192 4.2471
164 4J4H NAI 0.001099 0.42192 4.2471
165 3OID NDP 0.0000002348 0.5296 4.26357
166 3VZS NAP 0.00000003438 0.52307 4.28016
167 3VZS CAA 0.000000143 0.43817 4.28016
168 1O6Z NAD 0.000193 0.40295 4.29043
169 3WXB NDP 0.00000001144 0.61322 4.30108
170 3ICC NAP 0.0000001918 0.56176 4.31373
171 2Q2V NAD 0.0000001048 0.54173 4.31373
172 1MXH DHF 0.000002846 0.50546 4.34783
173 1MXH NAP 0.000003499 0.50228 4.34783
174 5IN4 NAP 0.0000001553 0.63388 4.4164
175 5IN4 6CK 0.0000001513 0.63388 4.4164
176 5IN4 GDP 0.0000001442 0.63376 4.4164
177 5L4S NAP 0.00000009412 0.55629 4.4164
178 5L4S 6KX 0.00000009412 0.55629 4.4164
179 1SQF SAM 0.002671 0.44223 4.4164
180 1F8G NAD 0.004437 0.42208 4.4164
181 5KMS NAD 0.002243 0.41885 4.4164
182 3NJ4 AFX 0.01389 0.41197 4.4164
183 2NAD NAD 0.001011 0.41084 4.4164
184 3NJ4 NAD 0.01536 0.41015 4.4164
185 1GR0 NAD 0.001131 0.40615 4.4164
186 1X7D ORN 0.001848 0.40441 4.4164
187 1LDN NAD 0.00009025 0.43567 4.43038
188 3QWI CUE 0.0000003226 0.54387 4.44444
189 3QWI NAP 0.000000201 0.52828 4.44444
190 3GEG NAD 0.00000009564 0.52041 4.45344
191 2VOH CIT 0.01412 0.4201 4.4586
192 4K28 NAD 0.003001 0.42034 4.46097
193 1HYE NAP 0.00007979 0.40839 4.47284
194 3IR1 MET 0.04816 0.40203 4.4898
195 1A27 NAP 0.00000008846 0.53138 4.49827
196 4M8D 23J 0.04132 0.40945 4.56274
197 1G0N PHH 0.00000002592 0.58324 4.59364
198 1G0N NDP 0.00000002106 0.58115 4.59364
199 1W73 NAP 0.000000004298 0.66901 4.63576
200 1W8D NAP 0.000000005767 0.53872 4.63576
201 1LLU NAD 0.001104 0.41594 4.73186
202 2I3G NAP 0.002074 0.41323 4.73186
203 3KB6 NAD 0.0004512 0.40334 4.73186
204 4AVB CMP 0.03419 0.40287 4.73186
205 5DOZ NDP 0.002987 0.40248 4.73186
206 1GV0 NAD 0.00003903 0.44305 4.83871
207 1GUZ NAD 0.00006999 0.43149 4.83871
208 3NUG NAD 0.0000000001906 0.62162 4.8583
209 2HMT NAI 0.0001319 0.4032 4.86111
210 4KWI NAP 0.0000003136 0.5141 4.94297
211 4KWI 1TJ 0.0000003004 0.50978 4.94297
212 3G2O SAM 0.00236 0.44472 5.01672
213 1XG5 NAP 0.0000001796 0.56774 5.01792
214 3V1Y NAD 0.0006096 0.44564 5.04732
215 1H9A NAP 0.0003522 0.42307 5.04732
216 2JHF NAD 0.01724 0.41221 5.04732
217 4DMG SAM 0.02759 0.40762 5.04732
218 1J0X NAD 0.003118 0.40254 5.04732
219 2PD4 DCN 0.000008856 0.48206 5.09091
220 2PD4 NAD 0.000008917 0.48194 5.09091
221 4YCA NDP 0.002077 0.42401 5.10204
222 4J7U YTZ 0.0000005195 0.53794 5.20833
223 4J7U NAP 0.0000005195 0.53794 5.20833
224 4D42 W0I 0.000002921 0.51986 5.31915
225 4D42 NAP 0.000002921 0.51986 5.31915
226 1Z6Z NAP 0.0000008519 0.49916 5.31915
227 2BH9 NAP 0.0000705 0.52608 5.36278
228 1LDM NAD 0.0000327 0.48546 5.36278
229 2CVQ NDP 0.0002346 0.45564 5.36278
230 4DPL NAP 0.0009508 0.4289 5.36278
231 2VHW NAI 0.001713 0.40441 5.36278
232 2F5X ASP 0.04689 0.40837 5.44872
233 3VC1 SAH 0.01389 0.4004 5.44872
234 3LST SAH 0.02195 0.4092 5.45977
235 5CG1 NAD BBN 0.00002829 0.49324 5.57377
236 1O94 ADP 0.00139 0.43734 5.67823
237 4OOE NDP 0.001611 0.4285 5.67823
238 1UWK NAD 0.0008854 0.42438 5.67823
239 3QV1 NAD 0.002598 0.42006 5.67823
240 2QZZ EMF 0.001269 0.41134 5.67823
241 2QZZ NAP 0.001178 0.41134 5.67823
242 2WW2 SWA 0.02999 0.4079 5.67823
243 1OAA OAA 0.0000002026 0.55422 5.79151
244 1A8S PPI 0.04205 0.405 5.86081
245 1WP4 NDP 0.0007118 0.43975 5.88235
246 2C3W GLC GLC GLC GLC 0.02735 0.41775 5.88235
247 1M0S CIT 0.01543 0.42845 5.93607
248 4XQC 13D 0.00009782 0.45816 5.99369
249 4XQC NAD 0.0001114 0.45497 5.99369
250 2E4G TRP 0.03771 0.41163 5.99369
251 5UAV TFB 0.00192 0.40267 5.99369
252 5UAV NDP 0.00192 0.40267 5.99369
253 1JA9 NDP 0.0000001428 0.53335 6.20438
254 3BAZ NAP 0.001779 0.42973 6.30915
255 4E5N NAD 0.0006575 0.4064 6.30915
256 2GCG NDP 0.005951 0.40044 6.30915
257 1XSE NDP 0.00000005585 0.56958 6.44068
258 3GXO SAH 0.0279 0.40082 6.50407
259 1QG6 TCL 0.000005164 0.50328 6.51341
260 1QG6 NAD 0.000005164 0.50328 6.51341
261 2ZAT NAP 0.0000002193 0.51967 6.53846
262 2JL1 NAP 0.00001602 0.42643 6.62021
263 4M38 SAH 0.005262 0.42196 6.62461
264 1TZJ A3B 0.03394 0.41632 6.62461
265 3CH6 311 0.0000007973 0.55215 6.64336
266 3CH6 NAP 0.0000007973 0.55215 6.64336
267 5KKA 6V0 0.00008801 0.43764 6.73077
268 2EXX NAP 0.0001498 0.43665 6.86275
269 4K26 NDP 0.0000002758 0.56065 6.88406
270 4K26 SFF 0.0000003646 0.51719 6.88406
271 1E5Q NDP 0.0001743 0.46071 6.94006
272 1SOW NAD 0.00001931 0.45959 6.94006
273 1GQ2 NAP 0.002307 0.41664 6.94006
274 3JV7 NAD 0.004189 0.40399 6.94006
275 4PIV NDP 0.00000003912 0.5456 6.9697
276 4O1M NAD 0.000001476 0.49074 6.98413
277 3MJE NDP 0.00000001495 0.55592 7.05645
278 4ITU NAI 0.000000005622 0.61352 7.0632
279 4ITU 1HS 0.000000007091 0.55489 7.0632
280 1XHL NDP 0.0000005533 0.51454 7.07071
281 1J5P NAD 0.00003396 0.49253 7.11462
282 1LVL NAD 0.005238 0.42204 7.25552
283 1Y8Q ATP 0.001803 0.43259 7.57098
284 1W6U NAP 0.000000003368 0.54669 7.61589
285 2DC1 NAD 0.0001749 0.41464 7.62712
286 5T9F TYR 0.00004917 0.46014 7.74908
287 5T9F NAP 0.0000825 0.45082 7.74908
288 2Z9I GLY ALA THR VAL 0.02603 0.42353 7.88644
289 1EZ4 NAD 0.0001157 0.41779 7.88644
290 3AB4 THR 0.03488 0.40957 7.88644
291 3AB4 LYS 0.02753 0.40768 7.88644
292 1P77 ATR 0.001075 0.49553 8.08823
293 1U8X NAD 0.004112 0.41194 8.20189
294 1NNU NAD 0.02941 0.41226 8.33333
295 1NNU TCT 0.02941 0.41226 8.33333
296 5EPO NAP 0.00003441 0.44916 8.39695
297 1O5I NAD 0.000006205 0.43119 8.43373
298 5H81 NAP 0.0009698 0.45091 8.51735
299 4YAG NAI 0.0000003596 0.5437 8.65052
300 1T9D P22 0.04514 0.40733 8.83281
301 4HXY NDP 0.000000001059 0.59758 9.13242
302 5MSO NAP 0.0000000006068 0.57966 9.14826
303 1PZG A3D 0.0000616 0.45087 9.14826
304 1LTH NAD 0.00005327 0.42278 9.46372
305 1R37 NAD 0.001437 0.40175 9.51009
306 2FR1 NDP 0.000000001591 0.63966 9.67078
307 1D7O NAD 0.000001587 0.50572 9.76431
308 1JG3 ADN 0.008881 0.41807 9.78723
309 1NYT NAP 0.00437 0.41358 9.9631
310 4Q9N NAI 0.000002479 0.48814 10.0671
311 1C3V NDP 0.000608 0.43351 10.2041
312 3GDH SAH 0.009443 0.40228 10.3734
313 3CMC NAD 0.004076 0.41385 10.4101
314 1ZMD NAI 0.004667 0.4124 10.4101
315 1GEG NAD 0.000000001231 0.65642 10.5469
316 2GZ3 NAP 0.0002409 0.44807 10.7256
317 3SJU NDP 0.00000001563 0.60806 10.7527
318 3OJF IMJ 0.000002527 0.51174 10.8949
319 3OJF NDP 0.000002853 0.49889 10.8949
320 1NVM NAD 0.0003654 0.44192 10.8974
321 4O0L NDP 0.000000009677 0.61598 10.9091
322 4QTU SAM 0.002387 0.44078 11.0577
323 2GDZ NAD 0.000000001739 0.58704 11.236
324 1RM0 NAI 0.000008044 0.44682 11.3565
325 1RM0 D6P 0.00002998 0.42093 11.3565
326 2AE2 NAP 0.0000000378 0.57565 11.5385
327 2AE2 PTO 0.0000000378 0.57565 11.5385
328 3EGI ADP 0.002878 0.47241 11.6505
329 1UZN NAP 0.000004163 0.41738 11.7409
330 5JAQ NAI 0.00006598 0.45828 11.9874
331 1U7T TDT 0.00000001343 0.5935 12.2605
332 1U7T NAD 0.000000004795 0.56068 12.2605
333 3ORF NAD 0.0000005762 0.49961 12.3506
334 4E13 NAD 0.0001293 0.40017 12.3675
335 3O03 NAP 0.000000003067 0.56107 12.3711
336 4GV8 DUP 0.02558 0.40266 12.426
337 3O26 NDP 0.000000008864 0.56273 12.5402
338 1Y1P NMN AMP PO4 0.0000001217 0.49563 12.6183
339 1E3W NAD 0.000000001742 0.65059 12.6437
340 1E6W NAD 0.000000001807 0.64998 12.6923
341 3D3W NAP 0.0000000977 0.5432 12.7049
342 1PR9 NAP 0.00000009784 0.54311 12.7049
343 3X01 AMP 0.02573 0.42328 12.9338
344 3OND ADN 0.003922 0.40255 12.9338
345 4K6B GLU 0.0413 0.40946 13.0435
346 3U31 NAD 0.01263 0.4022 13.1034
347 3T31 DCQ 0.00575 0.40269 13.2492
348 3T31 FAD 0.006176 0.40005 13.2492
349 5E8J SAH 0.003508 0.44854 13.4615
350 2BD0 NAP 0.00000002194 0.59701 13.5246
351 4J1Q NDP 0.0000000008738 0.58125 14.1956
352 2DTX BMA 0.000000001228 0.62699 14.7727
353 4CQM NAP 0.0000000006936 0.59947 14.9425
354 3AFN NAP 0.0000004303 0.52092 15.1163
355 3TY3 GGG 0.04248 0.40919 15.142
356 1Q7B NAP 0.000000005765 0.63051 15.1639
357 2JAH NDP 0.00000001802 0.55765 15.3846
358 1HDR NAD 0.00009327 0.40726 15.5738
359 5ITV NAI 0.000000001947 0.58914 15.6863
360 1BXK NAD 0.0000000009528 0.58622 15.7729
361 4TQG NDP 0.000000001965 0.57789 15.7729
362 2JAP NDP 0.00000002 0.60398 15.7895
363 5F5N NAD 0.00001728 0.4454 16.263
364 5JE8 NAD 0.0003021 0.46156 16.5563
365 4FC7 COA 0.00000002396 0.58615 16.6065
366 4FC7 NAP 0.00000002396 0.58615 16.6065
367 4PVD NDP 0.0000001872 0.50777 17.3502
368 1XKQ NDP 0.0000007326 0.51365 17.5
369 2C29 NAP 0.00000004924 0.57646 17.6656
370 2C29 DQH 0.0000001495 0.55899 17.6656
371 4QED NAP 0.00000001581 0.55408 17.7419
372 4U7W NDP 0.000000007048 0.55576 17.9811
373 4R1S NAP 0.000000003542 0.65827 18.2965
374 4EUE NAI 0.00001589 0.46485 19.2429
375 1VL8 NAP 0.00000000659 0.61097 19.4757
376 1GZ6 NAI 0.0000001656 0.56908 19.5584
377 1E3I CXF 0.002154 0.40091 19.8738
378 1FK8 NAD 0.000000483 0.57708 20.2335
379 1ZBQ NAD 0.0000001435 0.53258 20.5047
380 1H5Q NAP 0.00000001283 0.5628 20.7547
381 3LU1 NAD 0.0000000001323 0.69386 20.8791
382 1N7G GDR 0.000000004834 0.62984 21.7666
383 1N7G NDP 0.00000002243 0.619 21.7666
384 1UDB NAD 0.0000000002185 0.55099 21.7666
385 3A28 NAD 0.0000000005742 0.66922 22.093
386 1UAY ADN 0.0000004361 0.64056 22.314
387 2AG5 NAD 0.000000005685 0.56906 22.7642
388 1HDO NAP 0.00000004137 0.57659 22.8155
389 1ZEM NAD 0.0000000006455 0.58103 22.9008
390 1VL0 NAI 0.0000000001089 0.60135 22.9452
391 1RPN NDP 0.000000001573 0.61705 23.3438
392 2PZM UDP 0.00000006324 0.57253 23.3438
393 2PZM NAD 0.00000006324 0.57253 23.3438
394 1Z45 NAD 0.0000000002909 0.68063 23.6593
395 2X6T NAP 0.00000001482 0.55354 23.6593
396 1MUU NAD 0.0003464 0.4591 23.9748
397 1MV8 NAD 0.0001974 0.4134 23.9748
398 1EQ2 NAP 0.0000000166 0.55204 24.1935
399 4NBT NAD 0.0000000003634 0.60117 24.5833
400 1OC2 NAD 0.00000003224 0.59893 24.9211
401 1OC2 TDX 0.00000003224 0.59893 24.9211
402 5L4L NAP 0.000001214 0.47067 25
403 5L4L 7OX 0.00004202 0.46255 25
404 1N5D NDP 0.00000006098 0.5404 25.3472
405 1EK6 NAI 0.0000000003133 0.67135 25.552
406 1EK6 UPG 0.000000000753 0.66012 25.552
407 1WMA AB3 0.0000002531 0.55072 25.7246
408 1WMA NDP 0.0000002531 0.55072 25.7246
409 1KEW TYD 0.00000001051 0.61017 25.8675
410 1KEW NAD 0.00000003125 0.59409 25.8675
411 1SB8 UD2 0.0000000005387 0.66103 26.183
412 1SB8 NAD 0.000000001784 0.63545 26.183
413 1GY8 NAD 0.000000001196 0.5943 26.4984
414 2BGM NAJ 0.0000000001127 0.60525 26.6187
415 1EDO NAP 0.00000005546 0.54659 26.6393
416 1R6D NAD 0.00000001093 0.61382 26.8139
417 1R6D DAU 0.00000001948 0.6031 26.8139
418 1WVG APR 0.00000001105 0.53407 26.8139
419 2Q46 NAP 0.0000003591 0.50816 26.8775
420 3KO8 NAD 0.0000000002738 0.62185 26.9231
421 4NBU NAI 0.0000000005786 0.6625 27.2
422 2C5A NAD 0.000000003409 0.51371 27.7603
423 2C5A GDC 0.000000003409 0.51371 27.7603
424 1ORR NAD 0.0000000001008 0.64193 28.0757
425 3SJ7 NDP 0.00000001184 0.55344 28.1746
426 2PK3 A2R 0.0000000001757 0.54941 29.653
427 5T2U NAP 0.00000007675 0.54664 29.8387
428 2Q1W NAD 0.00000002557 0.59452 30.5994
429 4GLL NAD 0.00000000234 0.59055 30.5994
430 4NBW NAD 0.0000000003193 0.59621 31.5175
431 2Q1S NAI 0.0000001235 0.56201 31.8612
432 3RFV NAI 0.00000000007388 0.61676 32.5843
433 3RFV 15L 0.000000006449 0.54957 32.5843
434 4ZA2 NAD 0.00000002221 0.54509 34.3874
435 1RKX NAD 0.000000001323 0.64884 35.0158
436 4ZRN NAD 0.0000000003935 0.64996 46.1538
437 4ZRN UPG 0.000000002682 0.53167 46.1538
Pocket No.: 4; Query (leader) PDB : 3A4V; Ligand: PYR; Similar sites found: 348
This union binding pocket(no: 4) in the query (biounit: 3a4v.bio1) has 38 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1AE1 NAP 0.0000001854 0.5332 1.0989
2 2A92 NAI 0.0001681 0.42794 1.57729
3 1V35 NAI 0.00731 0.41497 1.57729
4 4RDH AMP 0.008698 0.42538 1.73611
5 1CER NAD 0.0002525 0.46119 1.89274
6 3CIF NAD 0.0005449 0.40551 1.89274
7 2B4R NAD 0.0007271 0.40514 1.89274
8 5JJR SAH 0.01982 0.40186 1.89274
9 3VPH OXM 0.0002583 0.43067 1.93548
10 3VPH NAD 0.0003416 0.42027 1.93548
11 4FN4 NAD 0.00000001114 0.5619 1.9685
12 2EWM NAD 0.002746 0.42045 2.00803
13 4OHU NAD 0.000009041 0.50713 2.07612
14 4OHU 2TK 0.000009041 0.50713 2.07612
15 2B4Q NAP 0.00000008745 0.53231 2.17391
16 2V6G NAP 0.000001337 0.49671 2.2082
17 1U1I NAD 0.0001349 0.43761 2.2082
18 5MQ6 NDP 0.003513 0.42339 2.2082
19 5DN9 NAD 0.0006113 0.41308 2.2082
20 4KBA 1QM 0.03089 0.41239 2.2082
21 4UP4 GAL NAG 0.04238 0.40779 2.2082
22 1OBB NAD 0.008157 0.40497 2.2082
23 5GT9 NAP 0.000001711 0.49354 2.28137
24 1GEE NAD 0.000000009192 0.62268 2.29885
25 1NFQ NAI 0.0000000002262 0.62501 2.30769
26 4OBW SAM 0.009981 0.41572 2.33463
27 2WSB NAD 0.000000005051 0.60695 2.3622
28 2DT5 NAD 0.0009359 0.43204 2.36967
29 5U5G NAP 0.0005228 0.4045 2.37288
30 1ZK4 AC0 0.01271 0.42718 2.39044
31 1ZK4 NAP 0.01271 0.42718 2.39044
32 2CFC NAD 0.000000003978 0.56951 2.4
33 3ZV6 NAD 0.002715 0.43219 2.4911
34 3ZV6 4HB 0.002875 0.43219 2.4911
35 1I2B UPG 0.0003544 0.47948 2.52366
36 1I2B NAD 0.0003544 0.47948 2.52366
37 1I2B USQ 0.0003544 0.47948 2.52366
38 3G5S FAD 0.001466 0.40797 2.52366
39 1Z82 NDP 0.006443 0.4015 2.52366
40 4RSL FAD 0.002098 0.40131 2.52366
41 1BDB NAD 0.01444 0.42154 2.52708
42 1IY8 NAD 0.0000000004425 0.61075 2.62172
43 1VPD TLA 0.01911 0.42305 2.67559
44 2PV7 NAD 0.0005394 0.44457 2.68456
45 3TN7 NJP 0.003714 0.41541 2.72374
46 3RJ5 NAD 0.00000002214 0.56381 2.75591
47 5T9E NAP 0.0000739 0.42593 2.83912
48 4GK9 MAN BMA MAN MAN MAN 0.04565 0.415 2.86738
49 2CUL FAD 0.001189 0.40752 3.01724
50 1X1T NAD 0.03602 0.40438 3.07692
51 3JQG NAP 0.0000007867 0.55782 3.125
52 3JQB NAP 0.0000008494 0.55649 3.125
53 4CM4 NAP 0.0000008626 0.55126 3.125
54 5JCJ NAP 0.0000008886 0.55076 3.125
55 4CMI NAP 0.000001004 0.54867 3.125
56 3JQF NAP 0.0000006102 0.50214 3.125
57 3BMQ NAP 0.0000006693 0.50173 3.125
58 5K6A NAP 0.0000007969 0.49871 3.125
59 3JQ9 NAP 0.0000008452 0.49796 3.125
60 4CLR NAP 0.0000006235 0.49733 3.125
61 4CME NAP 0.0000006724 0.49679 3.125
62 4CLO NAP 0.0000004979 0.49624 3.125
63 4CM9 NAP 0.000001011 0.4953 3.125
64 3BMO NAP 0.0000007645 0.49466 3.125
65 4CM8 NAP 0.0000007851 0.49415 3.125
66 3JQ8 NAP 0.00000117 0.4935 3.125
67 3BMN NAP 0.0000012 0.49283 3.125
68 5JDI NAP 0.0000008924 0.49273 3.125
69 5JDC NAP 0.0000009389 0.49246 3.125
70 3JQA NAP 0.0000006685 0.4923 3.125
71 3JQ7 NAP 0.000001325 0.48251 3.125
72 5JCJ 6JM 0.01253 0.43778 3.125
73 5L53 NAP 0.00000001457 0.51107 3.15457
74 2HJR APR 0.000001839 0.45907 3.15457
75 3TLJ SAH 0.003807 0.4219 3.15457
76 4XB2 HSE 0.000416 0.41538 3.15457
77 4XB2 NDP 0.000105 0.40903 3.15457
78 2Z3Y F2N 0.00315 0.40238 3.15457
79 3GGO ENO 0.00006025 0.46222 3.18471
80 3GGO NAI 0.00006025 0.46222 3.18471
81 3DXY SAM 0.008554 0.4334 3.21101
82 2VZ0 D64 0.000007777 0.52576 3.35821
83 2VZ0 NAP 0.000007777 0.52576 3.35821
84 2WD7 NAP 0.0000007596 0.49464 3.35821
85 2WYV NAD 0.000005403 0.4731 3.44828
86 3I6I NDP 0.00008317 0.4534 3.47003
87 3OA2 NAD 0.0002697 0.45326 3.47003
88 3V1U NAD 0.00146 0.42351 3.47003
89 1E7S NAP 0.004787 0.41243 3.47003
90 4OPC PGT 0.01679 0.40552 3.47003
91 2EG5 SAH 0.03099 0.40505 3.47003
92 1J49 NAD 0.0004626 0.40401 3.47003
93 4OPC FDA 0.0172 0.40223 3.47003
94 2VDV SAM 0.001661 0.46452 3.65854
95 5THQ NDP 0.00000001547 0.55548 3.67647
96 3OFK SAH 0.00611 0.4291 3.7037
97 3AY6 NAI 0.00000008303 0.55018 3.71747
98 3AY6 BGC 0.000000265 0.47622 3.71747
99 2GC0 PAN 0.02087 0.40381 3.7234
100 1SNY NAP 0.003318 0.41169 3.74532
101 5MDH NAD 0.00001034 0.45087 3.78549
102 4MDH NAD 0.00002399 0.441 3.78549
103 5VN0 NAI 0.00322 0.41627 3.78549
104 1H82 GZZ 0.003448 0.41395 3.78549
105 1H82 FAD 0.003159 0.41173 3.78549
106 5M67 ADE 0.003783 0.40398 3.78549
107 4ZGS NAD 0.0002402 0.40388 3.78549
108 5M67 NAD 0.004156 0.40247 3.78549
109 5M67 3D1 0.004534 0.40108 3.78549
110 3H4V DVP 0.000001164 0.5253 3.81944
111 3H4V NAP 0.000002383 0.51265 3.81944
112 5XVQ SAH 0.001777 0.43607 3.87324
113 1HYH NAD 0.0003142 0.44442 3.8835
114 3VYW SAM 0.007059 0.41627 3.8961
115 2DKN NAI 0.00000004588 0.53814 3.92157
116 2GUE NAG 0.01491 0.41421 4.09836
117 3ABI NAD 0.000006244 0.46834 4.10095
118 4GKV NAD 0.00032 0.42437 4.16667
119 2Q0L NAP 0.01873 0.40925 4.18006
120 4OSP NAP 0.0000002117 0.51426 4.18251
121 4CS9 AMP 0.02114 0.42851 4.2328
122 4J4H NAI 0.001099 0.42192 4.2471
123 4J4H 1J1 0.001099 0.42192 4.2471
124 3OID NDP 0.0000002348 0.5296 4.26357
125 3VZS NAP 0.00000003438 0.52307 4.28016
126 3VZS CAA 0.000000143 0.43817 4.28016
127 1O6Z NAD 0.000193 0.40295 4.29043
128 3WXB NDP 0.00000001144 0.61322 4.30108
129 2Q2V NAD 0.006655 0.4081 4.31373
130 1MXH DHF 0.000002846 0.50546 4.34783
131 1MXH NAP 0.000003499 0.50228 4.34783
132 5IN4 NAP 0.0000001553 0.63388 4.4164
133 5IN4 6CK 0.0000001513 0.63388 4.4164
134 5IN4 GDP 0.0000001442 0.63376 4.4164
135 5L4S NAP 0.00000009412 0.55629 4.4164
136 5L4S 6KX 0.00000009412 0.55629 4.4164
137 1F8G NAD 0.004437 0.42208 4.4164
138 5KMS NAD 0.002243 0.41885 4.4164
139 3NJ4 AFX 0.01389 0.41197 4.4164
140 2NAD NAD 0.001011 0.41084 4.4164
141 3NJ4 NAD 0.01536 0.41015 4.4164
142 1X7D ORN 0.001848 0.40441 4.4164
143 1LDN NAD 0.00009025 0.43567 4.43038
144 3QWI CUE 0.0000003226 0.54387 4.44444
145 3QWI NAP 0.000000201 0.52828 4.44444
146 4K28 NAD 0.003001 0.42034 4.46097
147 1A27 NAP 0.00414 0.41228 4.49827
148 4M8D 23J 0.04132 0.40945 4.56274
149 1G0N PHH 0.001492 0.44258 4.59364
150 1G0N NDP 0.001527 0.43892 4.59364
151 1W73 NAP 0.000000004298 0.66901 4.63576
152 1W8D NAP 0.000000005767 0.53872 4.63576
153 2I3G NAP 0.002074 0.41323 4.73186
154 1LLU NAD 0.001104 0.40571 4.73186
155 3KB6 NAD 0.0004512 0.40334 4.73186
156 4AVB CMP 0.03419 0.40287 4.73186
157 5DOZ NDP 0.002987 0.40248 4.73186
158 1GUZ NAD 0.00006999 0.43149 4.83871
159 3NUG NAD 0.0000000001906 0.62162 4.8583
160 1XG5 NAP 0.0000001796 0.52617 5.01792
161 3V1Y NAD 0.0006096 0.44564 5.04732
162 2JHF NAD 0.01724 0.41221 5.04732
163 4DMG SAM 0.02759 0.40762 5.04732
164 1J0X NAD 0.003118 0.40254 5.04732
165 2PD4 DCN 0.000008856 0.48206 5.09091
166 2PD4 NAD 0.000008917 0.48194 5.09091
167 4YCA NDP 0.002077 0.42401 5.10204
168 4J7U NAP 0.0000005195 0.53794 5.20833
169 4J7U YTZ 0.0000005195 0.53794 5.20833
170 4D42 NAP 0.000002921 0.51986 5.31915
171 4D42 W0I 0.000002921 0.51986 5.31915
172 1Z6Z NAP 0.0000008519 0.49916 5.31915
173 2CVQ NDP 0.0002346 0.45564 5.36278
174 4DPL NAP 0.0009508 0.4289 5.36278
175 2VHW NAI 0.001713 0.40441 5.36278
176 2F5X ASP 0.04689 0.40837 5.44872
177 5CG1 NAD BBN 0.00002829 0.49324 5.57377
178 4OOE NDP 0.001611 0.4285 5.67823
179 1UWK URO 0.0008854 0.42438 5.67823
180 1UWK NAD 0.0008854 0.42438 5.67823
181 2QZZ NAP 0.001178 0.41134 5.67823
182 2QZZ EMF 0.001269 0.41134 5.67823
183 1OAA OAA 0.01156 0.40878 5.79151
184 1A8S PPI 0.04205 0.405 5.86081
185 2C3W GLC GLC GLC GLC 0.02735 0.41775 5.88235
186 1M0S CIT 0.01543 0.42845 5.93607
187 4XQC 13D 0.00009782 0.45816 5.99369
188 4XQC NAD 0.0001114 0.45497 5.99369
189 2E4G TRP 0.03771 0.41163 5.99369
190 5UAV NDP 0.00192 0.40267 5.99369
191 5UAV TFB 0.00192 0.40267 5.99369
192 1JA9 NDP 0.01182 0.42412 6.20438
193 4E5N NAD 0.0006575 0.4064 6.30915
194 1XSE NDP 0.00000005585 0.56958 6.44068
195 1QG6 TCL 0.000005164 0.50328 6.51341
196 1QG6 NAD 0.000005164 0.50328 6.51341
197 2ZAT NAP 0.0000002193 0.51967 6.53846
198 1TZJ A3B 0.03394 0.41632 6.62461
199 3CH6 NAP 0.0000007973 0.55215 6.64336
200 3CH6 311 0.0000007973 0.55215 6.64336
201 5KKA 6V0 0.00008801 0.43764 6.73077
202 2EXX NAP 0.0001498 0.43665 6.86275
203 4K26 NDP 0.0000002758 0.56065 6.88406
204 4K26 SFF 0.0000003646 0.51719 6.88406
205 1E5Q NDP 0.0001743 0.46071 6.94006
206 4PIV NDP 0.00000003912 0.5456 6.9697
207 4O1M NAD 0.000001476 0.49074 6.98413
208 3MJE NDP 0.00000001495 0.55592 7.05645
209 4ITU 1HS 0.000000007091 0.60523 7.0632
210 4ITU NAI 0.000000005622 0.58388 7.0632
211 1Y8Q ATP 0.001803 0.43259 7.57098
212 1W6U NAP 0.000000003368 0.54669 7.61589
213 2DC1 NAD 0.0001749 0.41464 7.62712
214 5T9F TYR 0.00004917 0.46014 7.74908
215 5T9F NAP 0.0000825 0.45082 7.74908
216 1EZ4 NAD 0.0001157 0.41779 7.88644
217 3AB4 THR 0.03488 0.40957 7.88644
218 3AB4 LYS 0.02753 0.40768 7.88644
219 1P77 ATR 0.001075 0.49553 8.08823
220 1U8X NAD 0.004112 0.41194 8.20189
221 1NNU TCT 0.02941 0.41226 8.33333
222 1NNU NAD 0.02941 0.41226 8.33333
223 5EPO NAP 0.00003441 0.44916 8.39695
224 1O5I NAD 0.000006205 0.43119 8.43373
225 5H81 NAP 0.0009698 0.45091 8.51735
226 4YAG NAI 0.0000003596 0.5437 8.65052
227 1T9D P22 0.04514 0.40733 8.83281
228 4HXY NDP 0.000000001059 0.59758 9.13242
229 5MSO NAP 0.0000000006068 0.57966 9.14826
230 1PZG A3D 0.0000616 0.45668 9.14826
231 2FR1 NDP 0.000000001591 0.63966 9.67078
232 1NYT NAP 0.00437 0.41358 9.9631
233 4Q9N NAI 0.000002479 0.48814 10.0671
234 3GDH SAH 0.009443 0.40228 10.3734
235 3CMC NAD 0.004076 0.41385 10.4101
236 1GEG NAD 0.000000001231 0.65642 10.5469
237 2GZ3 NAP 0.0002409 0.44807 10.7256
238 3SJU NDP 0.00000001563 0.60806 10.7527
239 3OJF IMJ 0.000002527 0.51174 10.8949
240 3OJF NDP 0.000002853 0.49889 10.8949
241 1NVM NAD 0.0003654 0.41583 10.8974
242 4O0L NDP 0.000000009677 0.61598 10.9091
243 4QTU SAM 0.002387 0.44078 11.0577
244 2GDZ NAD 0.000663 0.44269 11.236
245 2AE2 PTO 0.0000000378 0.57565 11.5385
246 2AE2 NAP 0.0000000378 0.57565 11.5385
247 3EGI ADP 0.002878 0.47241 11.6505
248 5JAQ NAI 0.00006598 0.45828 11.9874
249 1U7T TDT 0.00000001343 0.5935 12.2605
250 1U7T NAD 0.000000004795 0.56068 12.2605
251 3ORF NAD 0.0000005762 0.49961 12.3506
252 3O03 NAP 0.01639 0.4118 12.3711
253 4GV8 DUP 0.02558 0.40266 12.426
254 3O26 NDP 0.000000008864 0.56273 12.5402
255 1Y1P NMN AMP PO4 0.0000001217 0.49563 12.6183
256 1E3W NAD 0.000000001742 0.65059 12.6437
257 1E6W NAD 0.000000001807 0.64998 12.6923
258 3D3W NAP 0.0000000977 0.5432 12.7049
259 1PR9 NAP 0.005202 0.41226 12.7049
260 3X01 AMP 0.02573 0.42328 12.9338
261 3OND ADN 0.003922 0.40255 12.9338
262 3OND NAD 0.003922 0.40255 12.9338
263 3U31 NAD 0.01263 0.4022 13.1034
264 5E8J SAH 0.003508 0.44854 13.4615
265 2BD0 NAP 0.00000002194 0.56055 13.5246
266 4J1Q NDP 0.0000000008738 0.58125 14.1956
267 2DTX BMA 0.0006819 0.45393 14.7727
268 4CQM NAP 0.0000000006936 0.59947 14.9425
269 3AFN NAP 0.0000004303 0.52092 15.1163
270 1Q7B NAP 0.000000005765 0.63051 15.1639
271 2JAH NDP 0.00000001802 0.55765 15.3846
272 5ITV NAI 0.000000001947 0.58914 15.6863
273 1BXK NAD 0.0000000009528 0.58622 15.7729
274 4TQG NDP 0.000000001965 0.57789 15.7729
275 2JAP NDP 0.00000002 0.60398 15.7895
276 5F5N NAD 0.00001728 0.4454 16.263
277 5JE8 NAD 0.0003021 0.46156 16.5563
278 4FC7 COA 0.00000002396 0.58615 16.6065
279 4FC7 NAP 0.00000002396 0.58615 16.6065
280 4PVD NDP 0.0000001872 0.50777 17.3502
281 1XKQ NDP 0.0000007326 0.51365 17.5
282 2C29 NAP 0.00000004924 0.57646 17.6656
283 2C29 DQH 0.0000001495 0.55899 17.6656
284 4QED NAP 0.00000001581 0.55408 17.7419
285 4U7W NDP 0.000000007048 0.55576 17.9811
286 4R1S NAP 0.000000003542 0.55904 18.2965
287 4EUE NAI 0.00001589 0.46485 19.2429
288 1VL8 NAP 0.00000000659 0.61097 19.4757
289 1GZ6 NAI 0.0000001656 0.56908 19.5584
290 1E3I CXF 0.002154 0.40091 19.8738
291 1FK8 NAD 0.000000483 0.49147 20.2335
292 1ZBQ NAD 0.0000001435 0.53258 20.5047
293 1H5Q NAP 0.00000001283 0.5628 20.7547
294 3LU1 NAD 0.0000000001323 0.69386 20.8791
295 1N7G GDR 0.000000004834 0.62984 21.7666
296 1N7G NDP 0.00000002243 0.619 21.7666
297 3A28 NAD 0.0000000005742 0.66922 22.093
298 2AG5 NAD 0.000000005685 0.56906 22.7642
299 1HDO NAP 0.00000004137 0.57659 22.8155
300 1ZEM NAD 0.0000000006455 0.58103 22.9008
301 1VL0 NAI 0.0000000001089 0.60135 22.9452
302 1RPN NDP 0.000000001573 0.61705 23.3438
303 2PZM UDP 0.00000006324 0.57253 23.3438
304 2PZM NAD 0.00000006324 0.57253 23.3438
305 2X6T NAP 0.00000001482 0.55354 23.6593
306 1Z45 NAD 0.0007877 0.43983 23.6593
307 1MUU NAD 0.0003464 0.4591 23.9748
308 1MV8 NAD 0.0001974 0.4134 23.9748
309 1EQ2 NAP 0.0000000166 0.55204 24.1935
310 4NBT NAD 0.0000000003634 0.60117 24.5833
311 1OC2 NAD 0.00000003224 0.59893 24.9211
312 1OC2 TDX 0.00000003224 0.59893 24.9211
313 5L4L NAP 0.000001214 0.47067 25
314 5L4L 7OX 0.00004202 0.46255 25
315 1N5D NDP 0.00000006098 0.5404 25.3472
316 1EK6 NAI 0.0000000003133 0.67135 25.552
317 1EK6 UPG 0.000000000753 0.66012 25.552
318 1WMA AB3 0.0000002531 0.55072 25.7246
319 1WMA NDP 0.0000002531 0.55072 25.7246
320 1KEW TYD 0.00000001051 0.61017 25.8675
321 1KEW NAD 0.00000003125 0.59409 25.8675
322 1SB8 UD2 0.0001735 0.49045 26.183
323 1SB8 NAD 0.0001567 0.48831 26.183
324 1GY8 NAD 0.000000001196 0.5943 26.4984
325 2BGM NAJ 0.00347 0.43996 26.6187
326 1EDO NAP 0.01041 0.42648 26.6393
327 1R6D DAU 0.0004332 0.47409 26.8139
328 1R6D NAD 0.0005153 0.47187 26.8139
329 1WVG APR 0.00151 0.42296 26.8139
330 2Q46 NAP 0.0000003591 0.50816 26.8775
331 3KO8 NAD 0.0005802 0.4478 26.9231
332 4NBU NAI 0.0000000005786 0.60634 27.2
333 2C5A NAD 0.000000003409 0.51371 27.7603
334 2C5A GDC 0.000000003409 0.51371 27.7603
335 1ORR NAD 0.0000000001008 0.64193 28.0757
336 3SJ7 NDP 0.004423 0.40983 28.1746
337 2PK3 A2R 0.0000000001757 0.54941 29.653
338 5T2U NAP 0.00000007675 0.54664 29.8387
339 2Q1W NAD 0.00000001194 0.60146 30.5994
340 4GLL NAD 0.00000000234 0.59055 30.5994
341 4NBW NAD 0.0000000003193 0.59621 31.5175
342 2Q1S NAI 0.005852 0.42072 31.8612
343 3RFV NAI 0.00003999 0.48573 32.5843
344 3RFV 15L 0.000522 0.44191 32.5843
345 4ZA2 NAD 0.00000002221 0.54509 34.3874
346 1RKX NAD 0.000000001323 0.59516 35.0158
347 4ZRN NAD 0.0000000003935 0.64996 46.1538
348 4ZRN UPG 0.000000002682 0.53167 46.1538
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