Receptor
PDB id Resolution Class Description Source Keywords
1PQU 1.92 Å EC: 1.2.1.11 CRYSTAL STRUCTURE OF THE H277N MUTANT OF ASPARTATE SEMIALDEH DEHYDROGENASE FROM HAEMOPHILUS INFLUENZAE BOUND WITH NADP, C YSTEINE SULFOXIDE AND CACODYLATE HAEMOPHILUS INFLUENZAE RD ENZYME L-ASPARTATE SEMIALDEHYDE CACODYLATE NADP OXIDORED
Ref.: THE ROLE OF SUBSTRATE-BINDING GROUPS IN THE MECHANI ASPARTATE-BETA-SEMIALDEHYDE DEHYDROGENASE. ACTA CRYSTALLOGR.,SECT.D V. 60 1388 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CAC A:1375;
B:2375;
C:3374;
D:4375;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
136.989 C2 H6 As O2 C[As]...
CYS A:1374;
B:2374;
C:3373;
D:4374;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
121.158 C3 H7 N O2 S C([C@...
NAP A:1372;
B:2372;
D:4372;
Valid;
Valid;
Valid;
none;
none;
none;
submit data
743.405 C21 H28 N7 O17 P3 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1TB4 2.15 Å EC: 1.2.1.11 CRYSTAL STRUCTURE OF ASPARTATE-SEMIALDEHYDE DEHYDROGENASE FR HAEMOPHILUS INFLUENZAE WITH A BOUND PERIODATE HAEMOPHILUS INFLUENZAE ASPARTATE-SEMIALDEHYDE DEHYDROGENASE ASPARTATE BIOSYNTHETICPERIODATE OXIDOREDUCTASE
Ref.: STRUCTURAL BASIS FOR DISCRIMINATION BETWEEN OXYANIO SUBSTRATES OR INHIBITORS IN ASPARTATE-BETA-SEMIALDE DEHYDROGENASE. ACTA CRYSTALLOGR.,SECT.D V. 60 2320 2004
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 1TA4 - ART As O4 [O-][As](=....
2 1TB4 Ki = 0.2 mM PEJ I O4 [O-]I(=O)(....
3 1PQU - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 1TA4 - ART As O4 [O-][As](=....
2 1TB4 Ki = 0.2 mM PEJ I O4 [O-]I(=O)(....
3 1PQU - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
4 1MB4 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
5 4R5M Ki = 0.076 mM 4NO C7 H6 N O7 P c1cc(c(cc1....
6 3PZR - NAP C21 H28 N7 O17 P3 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 4 families.
1 1TA4 - ART As O4 [O-][As](=....
2 1TB4 Ki = 0.2 mM PEJ I O4 [O-]I(=O)(....
3 1PQU - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
4 1MB4 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
5 4R5M Ki = 0.076 mM 4NO C7 H6 N O7 P c1cc(c(cc1....
6 3PZR - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAP; Similar ligands found: 127
No: Ligand ECFP6 Tc MDL keys Tc
1 NAP 1 1
2 NA0 0.881356 0.986301
3 TAP 0.872881 0.934211
4 NDO 0.840336 0.972603
5 NAD 0.811966 0.986111
6 N01 0.733871 0.958904
7 A3D 0.712 0.972603
8 NBP 0.707692 0.935065
9 NAD IBO 0.688 0.921053
10 NHD 0.68254 0.958904
11 NJP 0.661417 0.972973
12 NAJ PYZ 0.659091 0.898734
13 NFD 0.658915 0.934211
14 DND 0.619048 0.959459
15 NXX 0.619048 0.959459
16 ZID 0.605839 0.972603
17 NAQ 0.59854 0.922078
18 ATR 0.59292 0.917808
19 NAE 0.591241 0.946667
20 NDE 0.58042 0.986301
21 A22 0.571429 0.958904
22 AMP NAD 0.571429 0.933333
23 NAJ 0.567164 0.986111
24 A2R 0.563025 0.932432
25 NDC 0.561644 0.922078
26 NA7 0.552846 0.907895
27 ODP 0.551471 0.935065
28 A2P 0.539823 0.930556
29 8ID 0.537313 0.910256
30 NAD BBN 0.525974 0.865854
31 NPW 0.525547 0.8875
32 CNA 0.521739 0.959459
33 NZQ 0.521739 0.910256
34 NAD CJ3 0.519231 0.835294
35 NDP 0.514493 0.922078
36 PO4 PO4 A A A A PO4 0.503937 0.930556
37 DG1 0.503401 0.922078
38 1DG 0.503401 0.922078
39 NAD TDB 0.5 0.696078
40 TXP 0.5 0.922078
41 NMN AMP PO4 0.492958 0.921053
42 XNP 0.492958 0.875
43 25L 0.492308 0.958904
44 25A 0.492063 0.972222
45 NAD NDT 0.490909 0.747368
46 NMN 0.486726 0.888889
47 NGD 0.485714 0.935065
48 2AM 0.477876 0.891892
49 ADP 0.458333 0.945205
50 PAP 0.451613 0.931507
51 ADP MG 0.45082 0.906667
52 BEF ADP 0.447154 0.883117
53 ADP BEF 0.447154 0.883117
54 A2D 0.445378 0.945205
55 AN2 0.442623 0.932432
56 ADP PO3 0.44 0.944444
57 SAP 0.44 0.896104
58 AGS 0.44 0.896104
59 M33 0.439024 0.906667
60 AR6 AR6 0.438849 0.945205
61 BA3 0.438017 0.945205
62 ATP MG 0.436508 0.906667
63 ADP BMA 0.43609 0.92
64 OAD 0.43609 0.92
65 ATP 0.435484 0.945205
66 OOB 0.435115 0.958904
67 B4P 0.434426 0.945205
68 AP5 0.434426 0.945205
69 GAP 0.433071 0.92
70 0WD 0.432432 0.922078
71 5FA 0.432 0.945205
72 2A5 0.432 0.87013
73 AQP 0.432 0.945205
74 00A 0.428571 0.909091
75 CA0 0.427419 0.92
76 ALF ADP 0.426357 0.871795
77 ADP ALF 0.426357 0.871795
78 ACP 0.424 0.92
79 NAJ PZO 0.423841 0.897436
80 9SN 0.423358 0.897436
81 VO4 ADP 0.423077 0.932432
82 ANP MG 0.423077 0.896104
83 ADP VO4 0.423077 0.932432
84 WAQ 0.422222 0.884615
85 ACQ 0.421875 0.92
86 V3L 0.421875 0.945205
87 ADQ 0.421053 0.92
88 AR6 0.420635 0.918919
89 APR 0.420635 0.918919
90 ATP A A A 0.42029 0.958333
91 CO7 0.419753 0.786517
92 1ZZ 0.419118 0.841463
93 3OD 0.419118 0.92
94 DLL 0.41791 0.958904
95 AD9 0.417323 0.92
96 NAX 0.416667 0.875
97 OVE 0.416667 0.857143
98 MYR AMP 0.416058 0.841463
99 AV2 0.415385 0.868421
100 A3P 0.414634 0.944444
101 NNR 0.414414 0.72973
102 ALF ADP 3PG 0.413793 0.8625
103 OMR 0.413793 0.831325
104 LA8 ALF 3PG 0.413793 0.8625
105 ANP 0.410853 0.92
106 A1R 0.410448 0.860759
107 ABM 0.409836 0.893333
108 AMP 0.408333 0.944444
109 A 0.408333 0.944444
110 SON 0.408 0.933333
111 PPS 0.407692 0.829268
112 5AL 0.407692 0.932432
113 TYR AMP 0.407143 0.933333
114 NAI 0.406897 0.909091
115 7D3 0.406504 0.857143
116 DAL AMP 0.406015 0.932432
117 ADX 0.404762 0.829268
118 ATF 0.40458 0.907895
119 3UK 0.404412 0.945946
120 AMP DBH 0.404255 0.894737
121 139 0.402685 0.875
122 AMP MG 0.401639 0.893333
123 50T 0.401575 0.906667
124 SRP 0.401515 0.907895
125 A A 0.40146 0.972222
126 FA5 0.4 0.933333
127 3AM 0.4 0.90411
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1TB4; Ligand: PEJ; Similar sites found: 509
This union binding pocket(no: 1) in the query (biounit: 1tb4.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2Q37 3AL 0.001157 0.46372 None
2 2W3L DRO 0.03831 0.41561 None
3 2O66 FLC 0.02111 0.40675 None
4 1ZJ6 G3D 0.008547 0.40605 None
5 3FPZ AHZ 0.0009336 0.43107 0.920245
6 2NPX NAD 0.01224 0.40265 1.07817
7 4M51 BEZ 0.0103 0.43856 1.34771
8 2IZ1 ATR 0.005961 0.43739 1.34771
9 1QZZ SAM 0.001603 0.43031 1.34771
10 4JBI NDP 0.02297 0.40279 1.35135
11 1YHM AHD 0.01753 0.41043 1.38122
12 1PL6 572 0.000761 0.42742 1.40449
13 1PL6 NAD 0.0002556 0.40998 1.40449
14 1H2M OGA 0.00381 0.44646 1.43266
15 4B7E OGA 0.0159 0.41234 1.43266
16 3P3N AKG 0.0344 0.40165 1.43266
17 2BGM NAJ 0.001345 0.40505 1.43885
18 4L8V NAP 0.001269 0.41621 1.48368
19 4B7X NAP 0.001685 0.4156 1.4881
20 3O9Z NAD 0.003748 0.41493 1.60256
21 3O9Z AKG 0.008094 0.40068 1.60256
22 1OYB FMN 0.0005237 0.41876 1.61725
23 2YVF FAD 0.006756 0.41469 1.61725
24 2YVF NAD 0.007014 0.41469 1.61725
25 4J7H TLO 0.002861 0.40851 1.61725
26 1YKJ FAD 0.0111 0.40703 1.61725
27 5XHA FRU FRU 0.01043 0.40668 1.61725
28 1X7D ORN 0.001033 0.42871 1.71429
29 1X7D NAD 0.001725 0.40819 1.71429
30 4W6Z ETF 0.0003459 0.52261 1.72911
31 4W6Z 8ID 0.0007915 0.43198 1.72911
32 3CMC NAD 0.001989 0.44021 1.79641
33 3KB6 NAD 0.0004568 0.4258 1.79641
34 1O68 KIV 0.0142 0.40978 1.81818
35 2GCG NDP 0.002801 0.4003 1.81818
36 3ZPG 5GP 0.008056 0.45126 1.88679
37 2C5S AMP 0.003485 0.43119 1.88679
38 1A59 CIT 0.01225 0.42849 1.88679
39 1T10 F6P 0.01848 0.40938 1.88679
40 1E3I CXF 0.0005162 0.40576 1.88679
41 3GD4 NAD 0.01667 0.40541 1.88679
42 4EIP K2C 0.008139 0.40231 1.88679
43 2CDC XYP 0.002429 0.4359 1.91257
44 2CDC XYS 0.003248 0.43063 1.91257
45 1YQD NAP 0.002367 0.40996 1.91257
46 2C2A ADP 0.005365 0.40229 1.93798
47 3MD0 GDP 0.002326 0.43862 1.97183
48 1YB5 NAP 0.0007064 0.43134 1.9943
49 1LYX PGA 0.007073 0.40531 2.01613
50 1E4E ADP 0.0004555 0.43705 2.04082
51 3K3G MMU 0.001199 0.4598 2.05882
52 1RZM E4P 0.002624 0.46088 2.07101
53 1RZM PEP 0.00315 0.43839 2.07101
54 1UDB NAD 0.005535 0.41236 2.07101
55 1CKM GTP 0.005326 0.42339 2.12121
56 1QS8 IVA VAL VAL STA ALA STA 0.001444 0.40792 2.12766
57 2ZWS PLM 0.00339 0.4902 2.15633
58 3QV9 QV7 0.0007736 0.47159 2.15633
59 2QRK AMP 0.000196 0.45799 2.15633
60 2NVK NAP 0.0015 0.45245 2.15633
61 4CCO OGA 0.001667 0.45045 2.15633
62 5H81 NAP 0.006329 0.43617 2.15633
63 1E5F PLP 0.0011 0.43199 2.15633
64 4RQU NAD 0.0004414 0.43021 2.15633
65 2FZW NAD 0.002028 0.42367 2.15633
66 2NAD NAD 0.001556 0.41943 2.15633
67 2JC9 ADN 0.01028 0.41592 2.15633
68 2GSD NAD 0.002346 0.41256 2.15633
69 1ZK7 FAD 0.001049 0.40806 2.15633
70 2WPF WPF 0.02532 0.40638 2.15633
71 2WPF FAD 0.02574 0.40481 2.15633
72 1QF5 GDP 0.001632 0.40407 2.15633
73 1QF5 RPL 0.001632 0.40407 2.15633
74 2QJN KDG 0.007752 0.40376 2.15633
75 1UXG FUM 0.000005316 0.46844 2.26537
76 1UXG NAD 0.0001166 0.46677 2.26537
77 3HAD NAD 0.001842 0.43 2.27273
78 1KEV NDP 0.000563 0.43512 2.2792
79 5EQU AKG 0.01104 0.43706 2.29508
80 3F3E LEU 0.0005147 0.40858 2.31214
81 2WSB NAD 0.004367 0.40752 2.3622
82 3V1Y NAD 0.0002388 0.43194 2.37389
83 3BAZ NAP 0.00009777 0.47282 2.4024
84 2OWZ CIT 0.0003105 0.4972 2.40964
85 9LDT OXM 0.007857 0.46003 2.40964
86 9LDT NAD 0.0006293 0.42913 2.40964
87 9LDB NAD 0.0006736 0.42801 2.40964
88 4U9W COA 0.003318 0.40996 2.41546
89 2PZM NAD 0.007838 0.40034 2.42424
90 4M5P 23W 0.002642 0.46825 2.42588
91 1U3U BNF 0.0008295 0.43802 2.42588
92 4M5P MLA 0.0288 0.42909 2.42588
93 3ZGE ASP 0.02784 0.41675 2.42588
94 4J36 1HR 0.004051 0.41174 2.42588
95 4J36 FAD 0.002346 0.41011 2.42588
96 1MV8 NAD 0.001861 0.40038 2.42588
97 4COQ SAN 0.01095 0.42503 2.42915
98 1LDM NAD 0.0004503 0.43314 2.43161
99 3NFZ 3NF 0.009674 0.4039 2.44648
100 5GZ6 NDP 0.008187 0.4339 2.45399
101 5GZ6 7C3 0.01268 0.41937 2.45399
102 1K3T BRZ 0.0003825 0.44018 2.50696
103 4HZO COA 0.005087 0.4293 2.51572
104 3GM5 CIT 0.01767 0.4153 2.51572
105 3RF4 FUN 0.01142 0.41394 2.58621
106 1OC2 NAD 0.006637 0.41219 2.58621
107 3JV7 NAD 0.003126 0.40146 2.6087
108 2P69 PLP 0.02452 0.40379 2.61438
109 4M37 SAH 0.001321 0.41658 2.62391
110 4B9E FAH 0.003318 0.45596 2.65781
111 1Z44 NPO 0.01512 0.45305 2.66272
112 1Z41 FMN 0.001733 0.42455 2.66272
113 1RPN NDP 0.001332 0.40641 2.68657
114 1Y7P RIP 0.01292 0.43361 2.69058
115 1U1I NAD 0.0007554 0.43022 2.69542
116 2QF7 COA 0.001676 0.42956 2.69542
117 2Z9V PXM 0.006285 0.42528 2.69542
118 1H0C AOA 0.02115 0.41696 2.69542
119 3SQP FAD 0.03429 0.41569 2.69542
120 1Q11 TYE 0.01505 0.40867 2.69542
121 4DYO SD4 0.01185 0.40865 2.69542
122 4NM5 ADP 0.001411 0.40826 2.69542
123 3ETG GLU 0.009833 0.40372 2.69542
124 1LVL FAD 0.001434 0.40196 2.69542
125 1OAA OAA 0.00502 0.40803 2.7027
126 1AUA BOG 0.01887 0.40435 2.7027
127 2JFV FLC 0.002378 0.45601 2.74914
128 2Y7P SAL 0.00237 0.44378 2.75229
129 2CVQ NDP 0.001002 0.41714 2.75229
130 3B1F NAD 0.0000518 0.43741 2.75862
131 1SAY PYR 0.0000871 0.46618 2.77008
132 1ZK4 NAP 0.004433 0.40304 2.78884
133 1HKU NAD 0.0007659 0.41985 2.7933
134 1EZ4 NAD 0.0002273 0.4328 2.83019
135 1O9U ADZ 0.0077 0.45229 2.85714
136 2VAR KDF 0.0005822 0.45259 2.8754
137 2VAR KDG 0.004309 0.41793 2.8754
138 2VAR AMP 0.006031 0.41646 2.8754
139 2VAR ANP 0.001427 0.41167 2.8754
140 3I6I NDP 0.0006696 0.43721 2.89017
141 3DER ALA LYS 0.0007292 0.42158 2.89855
142 4MP8 NAD 0.0001045 0.46731 2.94985
143 4MP8 MLI 0.0000001492 0.46093 2.94985
144 3AYS CT3 0.001382 0.44274 2.96496
145 4EMI NAD 0.004035 0.42397 2.96496
146 3MJE NDP 0.0007938 0.42387 2.96496
147 4HXY NDP 0.001259 0.41774 2.96496
148 2ZJ5 ADP 0.01226 0.41747 2.96496
149 1I2B NAD 0.005006 0.41647 2.96496
150 1YBH FAD 0.0004909 0.41158 2.96496
151 3K37 BCZ 0.005068 0.40663 2.96496
152 1O6Z NAD 0.0002159 0.42645 2.9703
153 4K28 NAD 0.000179 0.4329 2.97398
154 1KYZ SAH 0.004099 0.40292 3.0137
155 1ZEM NAD 0.001226 0.407 3.05344
156 2AE2 PTO 0.000007021 0.41307 3.07692
157 2AE2 NAP 0.006282 0.40131 3.07692
158 1T26 GBD 0.0002424 0.45782 3.10559
159 1T26 NAI 0.0006593 0.44196 3.10559
160 2A92 NAI 0.0009219 0.42425 3.11526
161 3L0E G58 0.0002869 0.41617 3.16206
162 3H9E NAD 0.001111 0.40819 3.17919
163 1QDS PGA 0.003038 0.4287 3.18725
164 1KTC NGA 0.003281 0.43762 3.2345
165 2XDQ MGX 0.01997 0.43057 3.2345
166 1Q0H FOM 0.001612 0.42956 3.2345
167 1Q0H NDP 0.001794 0.42956 3.2345
168 1DLJ NAI 0.002256 0.42732 3.2345
169 1DLJ UGA 0.002329 0.42676 3.2345
170 2EJU SAH 0.001494 0.4186 3.2345
171 1ZFJ IMP 0.01047 0.4029 3.2345
172 1L8N GCW 0.001661 0.40253 3.2345
173 1Q6O LG6 0.0003733 0.44968 3.24074
174 1FW1 GSH 0.007886 0.40347 3.24074
175 1FBL HTA 0.008081 0.41124 3.24324
176 1SQ5 PAU 0.01919 0.40404 3.24675
177 2DWU DGL 0.005791 0.42185 3.26087
178 1R6D DAU 0.0055 0.41326 3.2641
179 1R6D NAD 0.006974 0.40982 3.2641
180 3F81 STT 0.002485 0.47795 3.27869
181 3JQ3 ADP 0.00233 0.43343 3.27869
182 1HDR NAD 0.00755 0.40528 3.27869
183 1I0Z OXM 0.007046 0.4543 3.3033
184 1DXY COI 0.007461 0.453 3.3033
185 1DXY NAD 0.0001036 0.44532 3.3033
186 1I0Z NAI 0.0005768 0.42909 3.3033
187 1NYT NAP 0.0008026 0.41108 3.32103
188 1H2B NAJ 0.002484 0.40916 3.34262
189 3W54 RNB 0.002075 0.42597 3.34347
190 1VL8 NAP 0.001536 0.40138 3.37079
191 1BXK NAD 0.002752 0.40045 3.38028
192 4B16 NAG 0.003765 0.47746 3.38346
193 2DC1 NAD 0.0002309 0.43756 3.38983
194 2HFK E4H 0.001456 0.453 3.44828
195 1QY1 PRZ 0.001417 0.41177 3.44828
196 3TKA CTN 0.01494 0.45165 3.45821
197 4R3L COA 0.002654 0.41552 3.46821
198 2YCD GTB 0.008479 0.40619 3.47826
199 1LDN NAD 0.0002733 0.44283 3.48101
200 1RYI GOA 0.001522 0.51513 3.50404
201 4WBD CIT 0.006569 0.4484 3.50404
202 1GQ2 NAP 0.0002452 0.43863 3.50404
203 4WBD ADP 0.01664 0.42203 3.50404
204 2R5T ANP 0.000931 0.41798 3.50404
205 3T31 DCQ 0.008661 0.40816 3.50404
206 3T31 FAD 0.01074 0.40288 3.50404
207 1G0N PHH 0.004419 0.40832 3.53357
208 1G0N NDP 0.004423 0.40525 3.53357
209 3CF6 SP1 0.005037 0.40706 3.59281
210 1EYQ NAR 0.01294 0.40704 3.6036
211 1VDC FAD 0.001548 0.40477 3.6036
212 3R6K FUC GAL GLA 0.02783 0.41114 3.60656
213 1SOW NAD 0.000296 0.443 3.65854
214 3AY6 BGC 0.009064 0.40287 3.71747
215 3AY6 NAI 0.005093 0.40179 3.71747
216 2EB5 OXL 0.00334 0.44913 3.74532
217 1R37 NAD 0.002729 0.40883 3.7464
218 1V7R CIT 0.02094 0.43672 3.76344
219 3ULK NDP 0.0001703 0.43872 3.77358
220 3WQQ NDP 0.0008598 0.43634 3.77358
221 3TFC PEP 0.004419 0.43197 3.77358
222 3QO8 SSA 0.001852 0.42346 3.77358
223 1JAY NAP 0.0002878 0.41654 3.77358
224 1WDA BAG 0.01583 0.40331 3.77358
225 3ABI NAD 0.0001276 0.45374 3.83562
226 3VPH NAD 0.0004783 0.43647 3.87097
227 3VPH OXM 0.0007593 0.43142 3.87097
228 4E13 NAD 0.0001744 0.41589 3.88693
229 1DSS NAD 0.0003817 0.4201 3.9039
230 1PZG A3D 0.0004849 0.44145 3.92749
231 1EYE PMM 0.0067 0.41028 3.92857
232 2DTJ THR 0.001903 0.43704 3.93258
233 3SIX GDP 0.0002657 0.46616 3.93939
234 2VQ5 LDP 0.03019 0.4211 3.9801
235 2VQ5 HBA 0.03257 0.40779 3.9801
236 2JBH 5GP 0.005636 0.42235 4
237 3ZUY TCH 0.007407 0.41279 4.02477
238 2Q8H TF4 0.005249 0.46099 4.04313
239 3L24 GOA 0.00864 0.44967 4.04313
240 4C6F DOR 0.002592 0.43153 4.04313
241 4C6F NCD 0.002592 0.43153 4.04313
242 2RAB NAD 0.005109 0.42305 4.04313
243 2O4C NAD 0.0009461 0.42243 4.04313
244 3OJO NAD 0.0005458 0.40931 4.04313
245 1VM6 NAD 0.001174 0.40504 4.04313
246 2RAB FAD 0.008121 0.40062 4.04313
247 2GN4 NDP 0.01563 0.41648 4.06977
248 2GN4 UD1 0.02755 0.40673 4.06977
249 4KGM ATP 0.005737 0.41297 4.08163
250 1GR0 NAD 0.003053 0.40696 4.08719
251 2WGC SIA GAL BGC 0.005516 0.47812 4.09357
252 1WGC SIA GAL BGC 0.01189 0.4502 4.09357
253 4JEJ 1GP 0.001613 0.43495 4.09836
254 1B4P GPS 0.001237 0.42154 4.14747
255 1HYE NAP 0.0004858 0.41225 4.15335
256 1RM4 NDP 0.000512 0.42412 4.1543
257 1Y9Q MED 0.01558 0.41786 4.16667
258 2DTX BMA 0.005287 0.40325 4.16667
259 3CIF NAD 0.0002624 0.43822 4.17827
260 3CIF G3H 0.0008956 0.42867 4.17827
261 1EBF NAD 0.00007477 0.44227 4.18994
262 5FI3 NAP 0.01534 0.40179 4.20168
263 1CFV E3G 0.02569 0.40062 4.20168
264 2DM6 IMN 0.003349 0.41102 4.2042
265 1CBF SAH 0.001019 0.43324 4.21053
266 4IDC 1XX 0.003496 0.40349 4.21687
267 1DIG NAP 0.00216 0.41019 4.24837
268 1DIG L37 0.002389 0.40981 4.24837
269 3E81 SLB 0.01695 0.41109 4.26829
270 4Q0A 4OA 0.003374 0.40595 4.30464
271 1QH9 LAC 0.01836 0.41452 4.31034
272 1H16 PYR 0.0117 0.43578 4.31267
273 1GJW GLC 0.01072 0.4313 4.31267
274 1H16 DTL 0.03035 0.42098 4.31267
275 3SHR CMP 0.004846 0.42037 4.31267
276 3CGD NAD 0.01013 0.41626 4.31267
277 1E5Q NDP 0.001841 0.40735 4.31267
278 4EPL JAI 0.005523 0.40555 4.31267
279 2AQJ TRP 0.01375 0.40055 4.31267
280 2AQJ FAD 0.01445 0.40032 4.31267
281 4O0L NDP 0.002187 0.40866 4.36364
282 2ZJF BSU 0.006761 0.41442 4.41989
283 3EW2 BTN 0.009935 0.41191 4.44444
284 4N7C AEF 0.005694 0.44461 4.54545
285 4E5N NAD 0.001013 0.42131 4.54545
286 3MAG 3MA 0.008688 0.45765 4.56026
287 4OSP NAP 0.001292 0.41295 4.56274
288 3GTD MLI 0.005352 0.43373 4.58221
289 4OOE NDP 0.000439 0.42333 4.58221
290 1N7G GDR 0.00554 0.41541 4.58221
291 1N7G NDP 0.01156 0.40994 4.58221
292 3A1I UNU 0.009273 0.40877 4.58221
293 1EK6 UPG 0.007796 0.40932 4.5977
294 1U7T TDT 0.006037 0.40297 4.5977
295 1ULE GLA GAL NAG 0.007938 0.44426 4.66667
296 1E7S NAP 0.001335 0.41815 4.6729
297 4TMK T5A 0.0003982 0.40519 4.69484
298 4G28 0W8 0.001226 0.45039 4.69799
299 1BTN I3P 0.01826 0.45075 4.71698
300 4JCA CIT 0.0003924 0.53093 4.79042
301 3BHO B4P 0.006828 0.46336 4.80769
302 2I3G NAP 0.00000005939 0.58131 4.82955
303 4K5S FAD 0.003741 0.40237 4.85075
304 4K5S PM0 0.009145 0.40192 4.85075
305 3O2K DST 0.009031 0.4184 4.85175
306 3PLN U5P 0.01026 0.41596 4.85175
307 3MTW M3R 0.005886 0.40451 4.85175
308 3O2K QRP 0.01502 0.40014 4.85175
309 3W8S GSH 0.01531 0.41308 4.85437
310 2HJR APR 0.0001394 0.42784 4.87805
311 3LST SAH 0.00652 0.40668 4.88506
312 3BY8 MLT 0.02965 0.40979 4.92958
313 2D2I NAP 0.0008181 0.4074 5
314 3I0O SMI 0.01297 0.41635 5.01475
315 3VZS NAP 0.002997 0.41788 5.05837
316 3L4S 3PG 0.00167 0.41575 5.05952
317 3L4S NAD 0.001552 0.41565 5.05952
318 4BVA NDP 0.0002783 0.44253 5.07463
319 4BVA T3 0.0005709 0.4399 5.07463
320 2BZ1 TAU 0.007443 0.47068 5.10204
321 2NU8 COA 0.0004363 0.422 5.12129
322 2FR1 NDP 0.001102 0.42131 5.12129
323 2PP3 LGT 0.002933 0.42014 5.12129
324 3UCL NAP 0.008027 0.41605 5.12129
325 2Y6P CTP 0.001568 0.44049 5.12821
326 3L6R MLI 0.0327 0.4077 5.20231
327 3WLE NAD 0.002177 0.41499 5.27859
328 2OHV NHL 0.001772 0.44361 5.30303
329 2BD0 NAP 0.003577 0.40186 5.32787
330 4GKV NAD 0.0007701 0.4299 5.35714
331 3SQG COM 0.01542 0.44401 5.39084
332 4LHM AZZ 0.003245 0.44354 5.39084
333 1KOL NAD 0.0009383 0.42912 5.39084
334 3IAE D7K 0.0001915 0.40722 5.39084
335 2Q1S NAI 0.006019 0.4049 5.39084
336 1CER NAD 0.0001721 0.45922 5.43807
337 3TN7 NJP 0.002374 0.40732 5.44747
338 4IMG NGF 0.001837 0.41158 5.46075
339 1QD0 RR6 0.001817 0.43289 5.46875
340 2DFV NAD 0.0001455 0.44385 5.4755
341 1HYH NAD 0.00036 0.4383 5.50162
342 2XNJ FAD 0.02092 0.40238 5.6391
343 4QED NAP 0.002148 0.40759 5.64516
344 4LO6 SIA GAL 0.005139 0.45018 5.66038
345 1J49 NAD 0.0004375 0.43014 5.70571
346 3LTW HLZ 0.0322 0.40301 5.71429
347 3TWO NDP 0.001176 0.42412 5.74713
348 1XX4 BAM 0.032 0.41975 5.74713
349 1YRX FMN 0.00634 0.40715 5.78512
350 2WMO GTP 0.005111 0.41078 5.78947
351 1C1L GAL BGC 0.0006298 0.4908 5.83942
352 2B7N NTM 0.02702 0.40187 5.86081
353 3B20 NAD 0.0001736 0.42982 5.8997
354 3B1J NAD 0.0007445 0.42492 5.8997
355 1PEA ACM 0.008615 0.44247 5.92992
356 1V8B NAD 0.0009283 0.4293 5.92992
357 1QO0 BMD 0.01948 0.4133 5.92992
358 2NCD ADP 0.0155 0.41284 5.92992
359 1UOU CMU 0.008643 0.40192 5.92992
360 2V5E SCR 0.001515 0.499 5.94059
361 1SB8 UD2 0.01102 0.40095 5.96591
362 1HDG NAD 0.0008081 0.43585 6.0241
363 2PV7 NAD 0.0007885 0.41712 6.04027
364 3QV1 NAD 0.001609 0.4038 6.09756
365 1TUV VK3 0.03194 0.4198 6.14035
366 2Q1A 2KT 0.01542 0.41807 6.14334
367 3AFN NAP 0.003554 0.40322 6.20155
368 4F8L GAL 0.001586 0.50902 6.2069
369 1OMO NAD 0.0007243 0.40908 6.21118
370 3C1O NAP 0.0006961 0.40901 6.23053
371 1HDO NAP 0.0007892 0.4295 6.31068
372 2OFD NGA 0.01409 0.41991 6.33803
373 1Y2W NAG 0.02152 0.41127 6.33803
374 5CAE COA 0.02216 0.40579 6.38978
375 2G5C NAD 0.001078 0.41887 6.40569
376 1Q3P GLU ALA GLN THR ARG LEU 0.01633 0.40274 6.42202
377 1P0F NAP 0.0004563 0.43586 6.43432
378 1BW9 NAD 0.00102 0.442 6.46067
379 1BXG NAD 0.001329 0.40602 6.46067
380 2YIV YIV 0.007506 0.44548 6.469
381 4EDF UPG 0.003159 0.41968 6.469
382 5AWQ GLC GLC 0.04316 0.41274 6.469
383 2YIV NBN 0.03969 0.40356 6.469
384 1C1X NAD 0.001111 0.42714 6.47887
385 4PLG OXM 0.000002229 0.47802 6.58683
386 4PLG NAI 0.0003735 0.44585 6.58683
387 1UF5 CDT 0.01283 0.40296 6.60066
388 2DT5 NAD 0.00006768 0.46016 6.63507
389 2VKL MLT 0.04449 0.41863 6.66667
390 1LLU NAD 0.0008477 0.4283 6.72515
391 4RJK PYR 0.01012 0.43896 6.73854
392 2F2U M77 0.004776 0.42063 6.73854
393 3S9K CIT 0.01278 0.4586 6.77966
394 2PR5 FMN 0.002903 0.40828 6.81818
395 3UEC ALA ARG TPO LYS 0.01004 0.43269 6.84932
396 1OGD RIP 0.00216 0.44553 6.87023
397 3R51 MMA 0.00504 0.46191 6.875
398 1WMA AB3 0.001783 0.42588 6.88406
399 3ZF8 GDP 0.009807 0.40777 6.88525
400 1YJQ NAP 0.0001319 0.45783 6.93069
401 1TDF NAP 0.0004835 0.4366 6.96203
402 1TDF FAD 0.0003369 0.42413 6.96203
403 1T0S BML 0.005953 0.45054 6.97674
404 3QDY CBS 0.006045 0.44336 6.99301
405 3QDY A2G GAL 0.01368 0.43236 6.99301
406 3QDT A2G GAL 0.02205 0.42188 6.99301
407 3CEV ARG 0.006914 0.41859 7.02341
408 2FOI JPA 0.006421 0.41534 7.0632
409 4IXW IXW 0.002549 0.43694 7.08661
410 1J5P NAD 0.0002806 0.43401 7.11462
411 1CF2 NAP 0.0004763 0.42276 7.12166
412 3SJ7 NDP 0.002212 0.40417 7.14286
413 3OND ADN 0.0002703 0.42807 7.27763
414 3OND NAD 0.002924 0.42104 7.27763
415 1DRV A3D 0.0002947 0.41582 7.32601
416 1ECM TSA 0.00136 0.44847 7.33945
417 1YKF NAP 0.0004573 0.43289 7.38636
418 1GUZ NAD 0.0001563 0.44684 7.41935
419 4K30 NLG 0.01263 0.41202 7.5
420 2BO4 FLC 0.004076 0.45164 7.54717
421 4C2G ALA ALA ALA ALA 0.001933 0.44202 7.54717
422 1RM0 NAI 0.001219 0.43441 7.54717
423 1RM0 D6P 0.001628 0.43216 7.54717
424 3GGO NAI 0.0003287 0.45278 7.64331
425 3GFB NAD 0.001101 0.42427 7.71429
426 1LTH NAD 0.0001543 0.43095 7.83699
427 1W7J ADP BEF 0.0002699 0.44995 7.94702
428 1D1T NAD 0.0003842 0.43869 8.08625
429 1NXJ TLA 0.002417 0.41703 8.19672
430 3SJU NDP 0.001251 0.41222 8.24373
431 1KEW TYD 0.005837 0.41062 8.31025
432 1KEW NAD 0.006895 0.40848 8.31025
433 3KMT SAH 0.005207 0.41047 8.40336
434 3GJB AKG 0.006566 0.41954 8.46395
435 1MZV AMP 0.0106 0.40638 8.51064
436 2DBZ NAP 0.0004039 0.43153 8.68263
437 3F8C HT1 0.02443 0.40386 8.73016
438 1B8U OAA 0.002605 0.4071 8.81459
439 1SC3 MLI 0.01588 0.42908 9.09091
440 4KWI 1TJ 0.004079 0.40969 9.12547
441 4KWI NAP 0.00428 0.40787 9.12547
442 1NU4 MLA 0.02463 0.43284 9.27835
443 3RK0 AMP 0.002511 0.42729 9.2827
444 2F1K NAP 0.0002303 0.43309 9.319
445 1JGS SAL 0.002647 0.49633 9.42029
446 2QA1 FAD 0.004636 0.40115 9.43396
447 2C29 NAP 0.003366 0.41493 9.49555
448 2B5W NAP 0.0005867 0.40801 9.52381
449 2B4R NAD 0.0004661 0.43406 9.56522
450 2B4R AES 0.001696 0.41146 9.56522
451 3SCH TB6 0.0004754 0.48858 9.59596
452 1ZZ7 S0H 0.00805 0.42058 9.59596
453 1GPJ CIT 0.03059 0.40406 9.7035
454 2RH4 EMO 0.002503 0.42194 9.74729
455 1SS4 GSH 0.0006336 0.53721 9.80392
456 3SJ0 DXC 0.006092 0.44319 9.85915
457 1F06 NDP 0.001913 0.41475 10
458 4DPL NAP 0.0000003752 0.54899 10.0279
459 4JK3 NAD 0.0001198 0.44384 10.0386
460 2FR6 URI 0.002254 0.41222 10.274
461 4ITU 1HS 0.005059 0.40696 10.4089
462 4J4H 1J1 0.0003817 0.45243 10.4247
463 4J4H NAI 0.0004588 0.45236 10.4247
464 2FEQ 34P 0.00583 0.40096 10.4247
465 2HK9 NAP 0.0006334 0.41772 10.5455
466 3NNF AKG 0.00361 0.44755 10.7817
467 1JN2 SFP 0.00001862 0.66156 10.9705
468 2Y7G AAE 0.00448 0.40898 10.9929
469 1C3V NDP 0.0005083 0.43264 11.0204
470 2VYN NAD 0.0007805 0.4205 11.1782
471 1GAD NAD 0.0003454 0.42679 11.2121
472 1GV0 NAD 0.0001669 0.44936 11.2903
473 2ZSC BTN 0.003201 0.41867 11.3475
474 1SC6 NAD 0.001657 0.41457 11.3861
475 1H8G CHT 0.003138 0.49211 11.5789
476 3KJQ B94 0.0005648 0.45311 11.5854
477 1B5E DCM 0.008564 0.41465 11.7886
478 1NVM NAD 0.00003203 0.47803 11.859
479 3BK2 U5P 0.001818 0.43288 11.8598
480 2QLX RM4 0.01844 0.41986 12.037
481 1TH8 ADP 0.007923 0.41159 12.069
482 2VHW NAI 0.0001257 0.46286 12.2016
483 3RJ5 NAD 0.001716 0.42128 12.2047
484 2QZZ NAP 0.001595 0.42138 12.2642
485 2QZZ EMF 0.001706 0.42138 12.2642
486 3UWB BB2 0.01101 0.42492 12.3377
487 2BOI MFU 0.007743 0.42132 12.3894
488 2QV7 ADP 0.0006588 0.44038 12.4629
489 2EV9 NAP 0.0005841 0.43178 12.5475
490 1GET FAD 0.01322 0.40571 12.6685
491 1GET NAP 0.01411 0.40571 12.6685
492 1NVT NAP 0.0003094 0.42183 12.892
493 2E1A MSE 0.001291 0.44943 13.3333
494 1M5B BN1 0.001369 0.41322 13.6882
495 1UW1 ADP 0.02768 0.40139 13.75
496 1Y75 NAG 0.008527 0.41473 14.4068
497 2V3B FAD 0.005155 0.40159 14.5455
498 4AF5 CIT 0.005468 0.43914 14.7368
499 3WBF API 0.0003581 0.44127 15.082
500 3WBF NAP 0.0003799 0.43262 15.082
501 2F59 INI 0.00302 0.40767 15.2866
502 1G8S MET 0.0009315 0.47497 16.087
503 1UO5 PIH 0.0008538 0.52436 17.6471
504 1UO4 PIH 0.009706 0.45502 17.6471
505 3A06 FOM 0.0004904 0.44002 17.7898
506 3A06 NDP 0.0004202 0.43999 17.7898
507 2QCX PF1 0.01972 0.4081 20.5323
508 2YLD CMO 0.001502 0.46531 23.622
509 1YOA FMN 0.01876 0.44767 30.1887
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