Receptor
PDB id Resolution Class Description Source Keywords
1HYE 1.9 Å EC: 1.1.1.27 CRYSTAL STRUCTURE OF THE MJ0490 GENE PRODUCT, THE FAMILY OF LACTATE/MALATE DEHYDROGENASE, DIMERIC STRUCTURE METHANOCALDOCOCCUS JANNASCHII NUCLEOTIDE BINDING DOMAIN OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF THE MJ0490 GENE PRODUCT OF THE HYPERTHERMOPHILIC ARCHAEBACTERIUM METHANOCOCCUS JANNASCHII, A NOVEL MEMBER OF THE LACTATE/MALATE FAMILY OF DEHYDROGENASES. J.MOL.BIOL. V. 307 1351 2001
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NAP A:748;
Valid;
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
1HYE 1.9 Å EC: 1.1.1.27 CRYSTAL STRUCTURE OF THE MJ0490 GENE PRODUCT, THE FAMILY OF LACTATE/MALATE DEHYDROGENASE, DIMERIC STRUCTURE METHANOCALDOCOCCUS JANNASCHII NUCLEOTIDE BINDING DOMAIN OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF THE MJ0490 GENE PRODUCT OF THE HYPERTHERMOPHILIC ARCHAEBACTERIUM METHANOCOCCUS JANNASCHII, A NOVEL MEMBER OF THE LACTATE/MALATE FAMILY OF DEHYDROGENASES. J.MOL.BIOL. V. 307 1351 2001
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 19 families.
1 1HYE - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 12 families.
1 1HYE - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50% Homology Family (88)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 177 families.
1 4PLT - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
2 4PLY - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
3 4PLW - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
4 4PLV - 2OP C3 H6 O3 C[C@@H](C(....
5 4PLH - OXM C2 H3 N O3 C(=O)(C(=O....
6 2V7P - OXM C2 H3 N O3 C(=O)(C(=O....
7 3VPH - FBP C6 H14 O12 P2 C([C@@H]1[....
8 1V6A - TRE C12 H22 O11 C([C@@H]1[....
9 1I0Z - OXM C2 H3 N O3 C(=O)(C(=O....
10 1T24 ic50 = 0.65 uM OXQ C3 H2 N2 O4 c1(c(non1)....
11 1U5A - BIK C11 H8 O4 c1cc(cc2c1....
12 1CET Ki = 1.3 mM CLQ C18 H26 Cl N3 CCN(CC)CCC....
13 1U4S - BIH C10 H8 O6 S2 c1cc(cc2c1....
14 4PLZ - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
15 1T2D - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
16 1T25 ic50 = 1.1 uM GAG C4 H3 N O4 c1c(c(no1)....
17 1T26 ic50 = 0.14 uM GBD C3 H2 N2 O3 S c1(c(nsn1)....
18 2A94 - AP0 C22 H32 N6 O14 P2 CC(C1=CN(C....
19 1LDG - OXM C2 H3 N O3 C(=O)(C(=O....
20 1T2C - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
21 1U4O - NDD C12 H8 O4 c1cc(cc2c1....
22 1XIV - RB2 C10 H20 Cl N O5 COC(C1CC(C....
23 1T2E - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
24 1OC4 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
25 1A5Z - FBP C6 H14 O12 P2 C([C@@H]1[....
26 1HYE - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
27 4QO7 Kd = 3.5 uM 36V C18 H15 N O4 S c1ccc(cc1)....
28 4AJE Kd = 210 uM 2B4 C9 H7 Br O5 c1cc(ccc1O....
29 4I9H Kd = 0.068 uM 1E4 C33 H31 Cl F N3 O12 S COc1cc(c(c....
30 5KKC - 6V0 C21 H29 N7 O14 P2 c1nc(c2c(n....
31 4AJP Kd = 0.093 uM 0SN C25 H27 N3 O6 S Cc1nc2ccc(....
32 4R68 ic50 = 6 nM W31 C28 H23 Cl3 O4 S C[C@@H](c1....
33 4ZVV ic50 = 0.003 uM GN0 C25 H23 Cl N2 O3 S2 c1ccc(c(c1....
34 4AJH Kd = 210 uM 2B4 C9 H7 Br O5 c1cc(ccc1O....
35 4RLS ic50 = 0.36 uM 49C C19 H15 Cl O3 S c1ccc2c(c1....
36 4QO8 Kd = 1.8 uM 36U C18 H13 Cl3 O2 S c1ccc(c(c1....
37 4AJ4 Kd = 130 uM VAB C14 H14 N2 O3 S2 C=CCSc1nc2....
38 4I8X Kd = 2300 uM 6P3 C12 H9 N O2 c1ccc(cc1)....
39 4AJN Kd = 0.069 uM 88V C24 H26 N4 O6 S Cc1nc2ccc(....
40 4M49 Kd = 5 uM 22Y C19 H17 Cl N4 O2 C[C@H](c1c....
41 1I10 - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
42 4I9N Kd = 360 uM 1E6 C18 H19 Cl N2 O7 S COc1cc(c(c....
43 4AJK Kd = 770 uM 88S C12 H14 N4 O2 S Cc1nc2ccc(....
44 5ES3 - OXM C2 H3 N O3 C(=O)(C(=O....
45 4AJ2 - MLI C3 H2 O4 C(C(=O)[O-....
46 4AJJ Kd = 280 uM 88R C12 H14 O6 COc1ccc(cc....
47 4AL4 Kd = 0.13 uM W7E C24 H26 N4 O7 S Cc1nc2ccc(....
48 5IXS ic50 = 0.042 uM 6EY C21 H16 Cl N O3 S2 c1ccc(c(c1....
49 4AJI Kd = 280 uM 88R C12 H14 O6 COc1ccc(cc....
50 3H3F - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
51 4AJO Kd = 0.093 uM 88N C25 H27 N3 O6 S Cc1nc2ccc(....
52 4JNK Kd = 5.1 uM ZHK C20 H15 Cl2 N5 O4 S2 C[C@H](C(=....
53 4AJL Kd = 160 uM 88W C14 H18 N4 O2 S CCNC(=O)NC....
54 5NQB Ki = 27 mM MLI C3 H2 O4 C(C(=O)[O-....
55 5NQQ Ki = 2.3 mM OAA C4 H3 O5 C(C(=O)C(=....
56 4I9U Kd = 137 uM 1E7 C15 H13 Cl N2 O4 S COc1ccc(cc....
57 4AJ1 Kd = 770 uM AJ1 C10 H11 N3 O S CC(=O)Nc1c....
58 1GV0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
59 2AA3 - AP0 C22 H32 N6 O14 P2 CC(C1=CN(C....
60 2A92 - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
61 1GUZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
62 4PLC - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
63 4PLF - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
64 4PLG - OXM C2 H3 N O3 C(=O)(C(=O....
65 1LLD - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
66 1LTH - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
67 1PZG Ki = 25 mM A3D C22 H28 N6 O14 P2 CC(=O)c1cc....
68 1PZH - OXL C2 O4 C(=O)(C(=O....
69 1PZF - OXL C2 O4 C(=O)(C(=O....
70 1LDM - OXM C2 H3 N O3 C(=O)(C(=O....
71 2HJR - CIT C6 H8 O7 C(C(=O)O)C....
72 1EZ4 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
73 1EMD - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
74 1IB6 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
75 5KKA Ki = 34 nM 6V0 C21 H29 N7 O14 P2 c1nc(c2c(n....
76 2CMD - CIT C6 H8 O7 C(C(=O)O)C....
77 1IE3 Ki = 56 mM PYR C3 H4 O3 CC(=O)C(=O....
78 1MLD - CIT C6 H8 O7 C(C(=O)O)C....
79 1UXH - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
80 1UXJ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
81 1UXK - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
82 1UR5 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
83 1GUY - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
84 1UXI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
85 1UXG - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
86 1O6Z - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
87 1SOW - OXL C2 O4 C(=O)(C(=O....
88 1LDN - NAD C21 H27 N7 O14 P2 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 : 1HYE; Ligand: NAP; Similar sites found: 519
This union binding pocket(no: 1) in the query (biounit: 1hye.bio1) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3S9K CIT 0.002203 0.49392 None
2 1TUV VK3 0.009043 0.44014 None
3 2B4Q NAP 0.0001515 0.42728 None
4 3KPE TM3 0.007022 0.42544 None
5 2JGS BTN 0.008294 0.414 None
6 1XVV CCQ 0.001047 0.42045 0.958466
7 4K28 NAD 0.000334 0.43755 1.11524
8 1YB5 NAP 0.00009694 0.41401 1.27796
9 1U5R ATP 0.003172 0.40559 1.27796
10 2AG8 NAP 0.0004302 0.43434 1.52091
11 2WSB NAD 0.0007598 0.45657 1.5748
12 2PZM NAD 0.002773 0.43515 1.59744
13 2IZ1 ATR 0.01226 0.41998 1.59744
14 2Q37 3AL 0.003568 0.43269 1.65746
15 1WP4 NDP 0.0001337 0.44078 1.7301
16 2CVZ NDP 0.0005313 0.42459 1.7301
17 3CIF NAD 0.0001361 0.47338 1.91693
18 1T10 F6P 0.0005217 0.46927 1.91693
19 3CIF G3H 0.0003091 0.46729 1.91693
20 3OA2 NAD 0.00003837 0.45233 1.91693
21 1VJT NAD 0.000699 0.44696 1.91693
22 1Q11 TYE 0.001553 0.44235 1.91693
23 1GAD NAD 0.0009089 0.43595 1.91693
24 3FC4 EDO 0.000899 0.43542 1.91693
25 1D1T NAD 0.00005816 0.43039 1.91693
26 2QV7 ADP 0.0007404 0.42863 1.91693
27 4OB6 S2T 0.001019 0.42357 1.91693
28 4DYO SD4 0.003291 0.42321 1.91693
29 2BII MTV 0.0004329 0.41132 1.91693
30 1C0I FAD 0.003356 0.40918 1.91693
31 1C0I BE2 0.003356 0.40918 1.91693
32 1X1T NAD 0.0003934 0.40042 1.92308
33 3OID NDP 0.0004275 0.45859 1.93798
34 4Q0A 4OA 0.002334 0.40246 1.98676
35 2V7T SAH 0.01266 0.41145 2.00669
36 4QED NAP 0.001836 0.42778 2.01613
37 3GEG NAD 0.002781 0.41741 2.02429
38 1PR9 NAP 0.0004615 0.45718 2.04918
39 1LUA NAP 0.0002914 0.44244 2.09059
40 4M5P MLA 0.001813 0.4854 2.23642
41 4HXY NDP 0.0001441 0.47556 2.23642
42 1F8F NAD 0.00003668 0.47312 2.23642
43 1PEA ACM 0.001825 0.46696 2.23642
44 2FZW NAD 0.001047 0.45368 2.23642
45 2NCD ADP 0.00123 0.45296 2.23642
46 1ZH8 NAP 0.0005576 0.44632 2.23642
47 2I3G NAP 0.00003047 0.4458 2.23642
48 1JQI FAD 0.0003869 0.4314 2.23642
49 1H6C SIN 0.003582 0.42629 2.23642
50 3FC2 IBI 0.0003693 0.42367 2.23642
51 1H6C NDP 0.003988 0.42214 2.23642
52 1WPQ NAD 0.001763 0.41916 2.23642
53 3V1U NAD 0.002412 0.41692 2.23642
54 2IXB NAD 0.0004102 0.41036 2.23642
55 1H2B NAJ 0.0001806 0.41029 2.23642
56 3Q9T FAY 0.002126 0.40895 2.23642
57 4M5P 23W 0.03717 0.40263 2.23642
58 2O2C G6Q 0.004 0.40191 2.23642
59 2AE2 PTO 0.000006805 0.49588 2.30769
60 2AE2 NAP 0.0005823 0.46158 2.30769
61 1FK8 NAD 0.0002128 0.44351 2.33463
62 3IOI 1GW 0.0007408 0.41674 2.34899
63 3H8V ATP 0.003866 0.4185 2.39726
64 2JFV FLC 0.001821 0.45206 2.4055
65 3SJU NDP 0.0001195 0.42377 2.50896
66 4O0L NDP 0.0007514 0.40052 2.54545
67 3OND ADN 0.0000001148 0.56678 2.55591
68 2O4C NAD 0.0000393 0.49924 2.55591
69 4KCT FDP 0.0000372 0.48872 2.55591
70 4TQG NDP 0.0001254 0.47486 2.55591
71 2BH9 NAP 0.0005149 0.46625 2.55591
72 3TKA CTN 0.007082 0.46366 2.55591
73 4J1Q NDP 0.0009439 0.43686 2.55591
74 1YBH FAD 0.002733 0.43577 2.55591
75 1ORR NAD 0.001497 0.43555 2.55591
76 3MD0 GDP 0.002033 0.4318 2.55591
77 4PIV NDP 0.002595 0.42285 2.55591
78 3B20 NAD 0.001697 0.42153 2.55591
79 2VYN NAD 0.0003643 0.41817 2.55591
80 2D2I NAP 0.001642 0.41483 2.55591
81 1Q7E MET 0.0006439 0.41117 2.55591
82 4EUE NAI 0.005877 0.40917 2.55591
83 3TKA SAM 0.001063 0.40638 2.55591
84 3GE7 AFQ 0.001759 0.40574 2.55591
85 3WLE NAD 0.0002473 0.47275 2.6393
86 1W6U NAP 0.004143 0.40571 2.64901
87 1W8D NAP 0.003191 0.40363 2.64901
88 2DTX BMA 0.0002237 0.47841 2.65152
89 3ICC NAP 0.0004085 0.40314 2.7451
90 1J5P NAD 0.0004555 0.42273 2.7668
91 1QDS PGA 0.008742 0.40132 2.78884
92 1O5I NAD 0.008408 0.40042 2.81124
93 2G5C NAD 0.0002811 0.46185 2.84698
94 1I9G SAM 0.005357 0.40213 2.85714
95 1X7D ORN 0.00006676 0.49847 2.8754
96 4W6Z 8ID 0.00008335 0.49297 2.8754
97 1X7D NAD 0.00008237 0.48245 2.8754
98 1LJ8 NAD 0.0001363 0.46848 2.8754
99 1SB8 UD2 0.000888 0.46439 2.8754
100 1SB8 NAD 0.0008435 0.46175 2.8754
101 1M2W NAD 0.0002904 0.45092 2.8754
102 2YYY NAP 0.0005267 0.44893 2.8754
103 3GFB NAD 0.00007826 0.44774 2.8754
104 1DSS NAD 0.00019 0.4452 2.8754
105 3ULK NDP 0.00003762 0.44103 2.8754
106 4WVH ASP HIS ASP ALA HIS ALA 0.001551 0.43663 2.8754
107 1ZJ6 G3D 0.00112 0.43166 2.8754
108 1V59 FAD 0.004401 0.42818 2.8754
109 1K3T BRZ 0.00363 0.41925 2.8754
110 1CKM GTP 0.004357 0.4182 2.8754
111 2XK9 XK9 0.001028 0.41473 2.8754
112 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.002524 0.40857 2.8754
113 2AQJ TRP 0.01885 0.40827 2.8754
114 2AQJ FAD 0.01947 0.40827 2.8754
115 2E5V FAD 0.01149 0.40802 2.8754
116 1X87 NAD 0.004452 0.40282 2.8754
117 3LAD FAD 0.01482 0.40227 2.8754
118 1REO FAD 0.01403 0.40054 2.8754
119 3BHO B4P 0.03432 0.41712 2.88462
120 3KO8 NAD 0.0002107 0.41091 2.88462
121 3O26 NDP 0.0001244 0.47665 2.89389
122 4B9E FAH 0.002364 0.45386 2.99003
123 2EB5 OXL 0.00009071 0.51112 2.99625
124 2PV7 NAD 0.0002376 0.43293 3.02013
125 1Y9Q MED 0.01573 0.40948 3.125
126 2JL1 NAP 0.0005079 0.43657 3.13589
127 2Q46 NAP 0.0001756 0.42975 3.16206
128 4E13 NAD 0.0002295 0.44633 3.18021
129 2GZ3 NAP 0.00000423 0.56485 3.19489
130 3MJE NDP 0.00005415 0.49174 3.19489
131 2VHW NAI 0.00014 0.48333 3.19489
132 1OMO NAD 0.00007866 0.47594 3.19489
133 1N9G NAP 0.000276 0.43948 3.19489
134 4RQU NAD 0.0001541 0.43318 3.19489
135 2IMP NAI 0.002757 0.43232 3.19489
136 1U8X NAD 0.0004737 0.42631 3.19489
137 4FWE FAD 0.007511 0.41615 3.19489
138 4R5M NAP 0.0004384 0.41506 3.19489
139 2YPO PHE 0.001557 0.40344 3.19489
140 4R5M 4NO 0.0005421 0.40249 3.19489
141 2IYG FMN 0.004674 0.40768 3.22581
142 1SQ5 ADP 0.003176 0.41417 3.24675
143 1YRX FMN 0.001804 0.41453 3.30579
144 2DT5 NAD 0.00002364 0.45962 3.31754
145 1HDO NAP 0.0001415 0.40911 3.39806
146 2PK3 A2R 0.00004725 0.4663 3.42679
147 3O03 NAP 0.001846 0.42327 3.43643
148 1QG6 NAD 0.006966 0.41759 3.44828
149 3E6J DR2 0.02636 0.41971 3.49345
150 3OJF IMJ 0.00572 0.41946 3.50195
151 3OJF NDP 0.005002 0.41569 3.50195
152 1PL6 NAD 0.00006006 0.4879 3.51438
153 1KEW TYD 0.0004264 0.47681 3.51438
154 1SAY PYR 0.0004187 0.46034 3.51438
155 1KEW NAD 0.001423 0.45435 3.51438
156 1GQ2 NAP 0.00007068 0.44314 3.51438
157 3V1Y NAD 0.0001469 0.44283 3.51438
158 2F2U M77 0.001241 0.43511 3.51438
159 2R5T ANP 0.0001828 0.43142 3.51438
160 1PL6 572 0.0001489 0.41885 3.51438
161 4OYA 1VE 0.01072 0.41784 3.51438
162 4E28 9MZ 0.01043 0.41761 3.51438
163 1TDF FAD 0.009746 0.41376 3.51438
164 2BJK NAD 0.003786 0.41287 3.51438
165 4MIG G3F 0.0131 0.40966 3.51438
166 2C29 NAP 0.00063 0.40956 3.51438
167 1L7E NAI 0.004187 0.40552 3.51438
168 1TDF NAP 0.03013 0.40536 3.51438
169 2ZJ5 ADP 0.01509 0.40517 3.51438
170 3JV7 NAD 0.0007653 0.4042 3.51438
171 3WBF NAP 0.001345 0.40204 3.51438
172 1JA9 NDP 0.001075 0.44031 3.64964
173 2O66 FLC 0.002375 0.44044 3.7037
174 2GDZ NAD 0.001818 0.42796 3.74532
175 1VL8 NAP 0.000191 0.41019 3.74532
176 2HNK SAH 0.001506 0.40514 3.76569
177 1JAY NAP 0.0007036 0.43901 3.77358
178 1BXK NAD 0.001105 0.43553 3.83387
179 3O2K DST 0.005161 0.42023 3.83387
180 3NYQ MCA 0.0009348 0.41344 3.83387
181 3NYQ AMP 0.001027 0.41344 3.83387
182 3F3E LEU 0.00172 0.41092 3.83387
183 4EIP K2C 0.01182 0.41004 3.83387
184 1NM5 NAP 0.01808 0.4049 3.83387
185 2XVE FAD 0.02932 0.40135 3.83387
186 2Y6P CTP 0.001232 0.43522 3.84615
187 4FR3 0V4 0.003672 0.42351 3.84615
188 3A28 NAD 0.0006521 0.4059 3.87597
189 4F4S EFO 0.01294 0.40326 3.94737
190 1SC6 NAD 0.0005087 0.454 3.9604
191 2OOR NAD 0.003909 0.40819 4.02299
192 1AE1 NAP 0.0007164 0.4491 4.0293
193 1PGP 6PG 0.0003313 0.46731 4.15335
194 1GJW GLC 0.001587 0.46201 4.15335
195 1WVG APR 0.00007007 0.46173 4.15335
196 1GJW MAL 0.001655 0.43012 4.15335
197 1YKJ FAD 0.01284 0.41849 4.15335
198 2F5Z FAD 0.007603 0.41592 4.15335
199 1TB4 PEJ 0.0004858 0.41225 4.15335
200 3TFC PEP 0.01065 0.40685 4.15335
201 2B5W NAP 0.0001479 0.40636 4.15335
202 1OYB FMN 0.0007686 0.40355 4.15335
203 3CH6 311 0.001701 0.45799 4.1958
204 1XX4 BAM 0.01053 0.43676 4.21456
205 1YJQ NAP 0.0002432 0.40668 4.29043
206 2F1K NAP 0.0003353 0.43133 4.30108
207 4FC7 NAP 0.004025 0.42709 4.33213
208 1VI2 NAD 0.0008358 0.43592 4.33333
209 1G8S MET 0.001032 0.46324 4.34783
210 4K26 NDP 0.0006567 0.40155 4.34783
211 3F81 STT 0.0003812 0.51022 4.37158
212 1VM6 NAD 0.00002024 0.50204 4.38596
213 2QZZ NAP 0.003836 0.42286 4.40252
214 2QZZ EMF 0.004064 0.42286 4.40252
215 2RHQ GAX 0.001209 0.40092 4.42177
216 2ZWS PLM 0.0004961 0.52775 4.47284
217 2C5S AMP 0.0003893 0.46126 4.47284
218 3ABI NAD 0.00002328 0.45428 4.47284
219 3CTY FAD 0.004773 0.42572 4.47284
220 3ICS ADP 0.006025 0.42521 4.47284
221 3ETG GLU 0.007643 0.42324 4.47284
222 4AT0 FAD 0.001584 0.42235 4.47284
223 3ETG GTP 0.006734 0.41913 4.47284
224 1WDA BAG 0.004206 0.41883 4.47284
225 1KTC NGA 0.007049 0.41448 4.47284
226 4KQI RBZ 0.001049 0.41042 4.47284
227 4KQI NIO 0.001049 0.41042 4.47284
228 1V5F TPP 0.03407 0.40989 4.47284
229 1V5F FAD 0.03407 0.40989 4.47284
230 3A4V NAD 0.00007979 0.40839 4.47284
231 2RAB FAD 0.01207 0.40795 4.47284
232 3FWN ATR 0.007592 0.40681 4.47284
233 4TM3 FAD 0.02893 0.40509 4.47284
234 1NPD NAD 0.0005696 0.4335 4.51389
235 1ZZ7 S0H 0.005321 0.41967 4.54545
236 4CQM NAP 0.0008428 0.40161 4.5977
237 3TN7 NJP 0.00007049 0.48859 4.66926
238 2PD4 DCN 0.002742 0.42684 4.72727
239 2PD4 NAD 0.002967 0.42538 4.72727
240 3ORF NAD 0.0001714 0.42826 4.78088
241 3OJO NAD 0.0001594 0.46148 4.79233
242 1O9U ADZ 0.007868 0.44323 4.79233
243 1KOL NAD 0.001571 0.43837 4.79233
244 1KBI PYR 0.0003305 0.42038 4.79233
245 1KBI FMN 0.0003305 0.42038 4.79233
246 3T31 DCQ 0.01246 0.41579 4.79233
247 3T31 FAD 0.0116 0.41579 4.79233
248 2FR6 CTN 0.0002657 0.43503 4.79452
249 2JAH NDP 0.0003434 0.40918 4.8583
250 1UZN NAP 0.00142 0.40062 4.8583
251 1C3V NDP 0.000008766 0.4624 4.89796
252 1UAY ADN 0.01476 0.40275 4.95868
253 1NFQ NAI 0.003183 0.42041 5
254 1E6W NAD 0.0005278 0.40953 5
255 4Q9N NAI 0.004453 0.41299 5.03356
256 4NBW NAD 0.00177 0.42555 5.05837
257 3A2Y TS5 0.002504 0.40527 5.07614
258 2DKN NAI 0.0006319 0.41086 5.09804
259 2DBZ NAP 0.00004304 0.49418 5.11182
260 1E7S NAP 0.00007392 0.48931 5.11182
261 1DXY NAD 0.0001465 0.46861 5.11182
262 1I2B NAD 0.00131 0.45849 5.11182
263 2GCG NDP 0.00003733 0.45495 5.11182
264 1Z44 NPO 0.01574 0.44386 5.11182
265 2XDQ MGX 0.01759 0.42534 5.11182
266 1RPN NDP 0.0001205 0.41978 5.11182
267 1EBF NAD 0.001915 0.4194 5.11182
268 1Z45 NAD 0.0002812 0.41665 5.11182
269 3LU1 NAD 0.000338 0.41371 5.11182
270 3CGD NAD 0.02426 0.4129 5.11182
271 1Z44 FMN 0.00314 0.40994 5.11182
272 2NVK NAP 0.02353 0.40835 5.11182
273 3GTD MLI 0.01315 0.4078 5.11182
274 1QZZ SAM 0.003587 0.40777 5.11182
275 2EJU SAH 0.002246 0.40303 5.11182
276 1FWV SGA MAG FUC 0.03255 0.40657 5.22388
277 4PTZ FMN 0.000703 0.42484 5.2356
278 2AG5 NAD 0.007078 0.40325 5.28455
279 4OSP NAP 0.0003212 0.42144 5.32319
280 2BD0 NAP 0.0004669 0.4006 5.32787
281 1CDO NAD 0.00006516 0.48311 5.43131
282 3C1O NAP 0.001088 0.42942 5.43131
283 1H82 GZZ 0.003184 0.42045 5.43131
284 4E5N NAD 0.0003156 0.41468 5.43131
285 1PJS NAD 0.0007633 0.41122 5.43131
286 1H82 FAD 0.005107 0.4109 5.43131
287 2C31 ADP 0.008718 0.41024 5.43131
288 2NLI LAC 0.00433 0.40879 5.43131
289 2NLI FMN 0.00433 0.40879 5.43131
290 1PS9 FAD 0.01116 0.40676 5.43131
291 3I0O ADP 0.00742 0.40417 5.43131
292 3WMX NAD 0.002173 0.40047 5.43131
293 4F8L GAL 0.0006933 0.51964 5.51724
294 3FXU TSU 0.0002999 0.41816 5.57377
295 2VT3 ATP 0.00001339 0.44743 5.5814
296 2OFE NAG 0.02502 0.40025 5.6338
297 4COQ SAN 0.006779 0.42613 5.66802
298 4JWX 1N4 0.0008901 0.45259 5.71429
299 1YQD NAP 0.000139 0.41466 5.7377
300 3BAZ NAP 0.0000351 0.47409 5.7508
301 1P0F NAP 0.0002134 0.46991 5.7508
302 1F8G NAD 0.003332 0.41107 5.7508
303 4CKU P2F 0.005377 0.40381 5.7508
304 1U7Z PMT 0.0007369 0.41818 5.75221
305 2ZAT NAP 0.0007725 0.40392 5.76923
306 1WMA AB3 0.0004067 0.47168 5.7971
307 3B1F NAD 0.0001184 0.47101 5.86207
308 3QWI CUE 0.002265 0.43701 5.92593
309 3QWI NAP 0.001414 0.43529 5.92593
310 4BVA NDP 0.0001307 0.47734 6.07029
311 4BVA T3 0.0002472 0.47531 6.07029
312 2DFV NAD 0.0001458 0.47044 6.07029
313 2Q1S NAI 0.003535 0.43052 6.07029
314 1HDG NAD 0.000702 0.42339 6.07029
315 2QRK AMP 0.004304 0.42178 6.07029
316 4M51 BEZ 0.02179 0.41414 6.07029
317 1YKF NAP 0.0007118 0.40543 6.07029
318 2RGO FAD 0.01201 0.4015 6.07029
319 2EV9 NAP 0.001445 0.43488 6.08365
320 2YY7 NAD 0.001074 0.43895 6.08974
321 2BGM NAJ 0.0004424 0.44883 6.11511
322 1GEE NAD 0.0008133 0.40243 6.13027
323 1U7T NAD 0.001629 0.40111 6.13027
324 1HKU NAD 0.00006449 0.43634 6.14525
325 1Q7B NAP 0.0007738 0.40432 6.14754
326 3NGL NAP 0.003727 0.41229 6.15942
327 4J4H 1J1 0.0003455 0.47478 6.17761
328 4J4H NAI 0.0004932 0.4711 6.17761
329 4JK3 NAD 0.0006122 0.44302 6.17761
330 4CO3 ATP 0.005119 0.40053 6.25
331 4IXW IXW 0.007344 0.40888 6.29921
332 4IDC 1XX 0.009482 0.40155 6.3253
333 1SNY NAP 0.0006564 0.44177 6.36704
334 1YS4 NAP 0.00002295 0.49025 6.38978
335 4DPL NAP 0.00003147 0.45251 6.38978
336 4MP8 NAD 0.0008468 0.45107 6.38978
337 4RJK PYR 0.004831 0.44628 6.38978
338 4GLL NAD 0.001417 0.43524 6.38978
339 3A06 NDP 0.0000237 0.43092 6.38978
340 4MP8 MLI 0.0005137 0.42853 6.38978
341 4LHM AZZ 0.005765 0.42355 6.38978
342 2WPF WPF 0.02165 0.42127 6.38978
343 2WPF FAD 0.02278 0.4202 6.38978
344 3A06 FOM 0.00002787 0.41936 6.38978
345 3PLN U5P 0.01015 0.40775 6.38978
346 3TWO NDP 0.000125 0.40635 6.38978
347 1LSS NAD 0.0006377 0.44464 6.42857
348 1I36 NAP 0.00004088 0.48545 6.43939
349 2QLX RM4 0.01315 0.41871 6.48148
350 1N5D NDP 0.0002458 0.41611 6.59722
351 2BKA NDP 0.000007863 0.47483 6.61157
352 1R37 NAD 0.0002515 0.46975 6.70927
353 3P7I P7I 0.002735 0.43193 6.70927
354 3I8P 840 0.001678 0.41568 6.70927
355 3RFV NAI 0.0004282 0.42193 6.74157
356 3RFV 15L 0.000741 0.41666 6.74157
357 4U9W COA 0.0003746 0.40166 6.76329
358 2Q1A 2KT 0.005555 0.43007 6.82594
359 3MAG 3MA 0.007822 0.45157 6.84039
360 3MAG SAH 0.0006029 0.4185 6.84039
361 3V91 UPG 0.006869 0.40009 6.87285
362 3NUG NAD 0.002068 0.42699 6.88259
363 1EDO NAP 0.0001071 0.48252 6.96721
364 1O0S NAI 0.00004153 0.48517 7.02875
365 1RZM E4P 0.003621 0.44514 7.02875
366 2B4R AES 0.0002024 0.42148 7.02875
367 3A1I UNU 0.003567 0.41685 7.02875
368 2B4R NAD 0.0002329 0.41469 7.02875
369 1QF5 RPL 0.0028 0.41372 7.02875
370 1QF5 GDP 0.0028 0.41372 7.02875
371 2YVF NAD 0.02305 0.40617 7.02875
372 2YVF FAD 0.02234 0.40617 7.02875
373 1RZM PEP 0.0116 0.40527 7.02875
374 2Q2V NAD 0.000521 0.45496 7.05882
375 1XG5 NAP 0.0002574 0.41486 7.16846
376 1SS4 GSH 0.001765 0.50758 7.18954
377 1SS4 CIT 0.006498 0.46428 7.18954
378 2DC1 NAD 0.0007883 0.4401 7.20339
379 1L2T ATP 0.0009847 0.4002 7.23404
380 1ZEM NAD 0.001051 0.43334 7.25191
381 1A27 NAP 0.001086 0.43733 7.26644
382 1Y42 TYR 0.0001267 0.48846 7.34824
383 4OOE NDP 0.00004189 0.46409 7.34824
384 1EK6 UPG 0.001496 0.45671 7.34824
385 1H9A NAP 0.001287 0.43961 7.34824
386 1RYI FAD 0.001966 0.41532 7.34824
387 1RYI GOA 0.00325 0.4078 7.34824
388 2ZB3 NDP 0.002046 0.4244 7.36544
389 3OCZ SRA 0.001701 0.41123 7.63359
390 2HMT NAI 0.0004452 0.44723 7.63889
391 1R6D NAD 0.0002522 0.48978 7.66773
392 1R6D DAU 0.000816 0.46603 7.66773
393 3KB6 NAD 0.00006774 0.45075 7.66773
394 2ZJF BSU 0.001953 0.42726 7.66773
395 2FR1 NDP 0.0002025 0.41422 7.66773
396 4J36 1HR 0.008543 0.41369 7.66773
397 4J36 FAD 0.004998 0.41336 7.66773
398 2BRY FAD 0.005286 0.41233 7.66773
399 1DJN ADP 0.004374 0.40313 7.66773
400 3QMN A3P 0.01229 0.42476 7.75194
401 3CF6 SP1 0.001811 0.41448 7.78443
402 2V5E SCR 0.0146 0.43708 7.92079
403 1T0S BML 0.001844 0.46673 7.98722
404 1BXG NAD 0.0001745 0.46548 7.98722
405 1BW9 NAD 0.0002443 0.458 7.98722
406 1C1X NAD 0.0002688 0.43505 7.98722
407 4GKV NAD 0.00005803 0.42035 7.98722
408 4O1M NAD 0.006006 0.40624 7.98722
409 1ULE GLA GAL NAG 0.009102 0.43279 8
410 2JBH 5GP 0.005039 0.41561 8
411 1NVT NAP 0.001367 0.42536 8.01394
412 1C1L GAL BGC 0.02524 0.40528 8.0292
413 1XHL NDP 0.0003956 0.4586 8.30671
414 1FIQ FAD 0.0006304 0.42175 8.30671
415 2PP3 LGT 0.004051 0.40578 8.30671
416 1M5B BN1 0.007461 0.40499 8.36502
417 1KYQ NAD 0.003056 0.42678 8.39416
418 2C2A ADP 0.001026 0.41902 8.52713
419 3CMC NAD 0.003598 0.44583 8.6262
420 1KGQ NPI 0.00976 0.40984 8.75912
421 1DRV A3D 0.0001712 0.46439 8.79121
422 3UEC ALA ARG TPO LYS 0.006774 0.43232 8.90411
423 2Q8H TF4 0.00147 0.48038 8.94569
424 3R75 PYR 0.009739 0.4319 8.94569
425 1WDK NAD 0.001704 0.41975 8.94569
426 1LLU NAD 0.0000616 0.41889 8.94569
427 4CNK FAD 0.01305 0.40094 8.94569
428 3NOJ PYR 0.009536 0.41138 9.2437
429 1J49 NAD 0.0001498 0.47164 9.26518
430 3H9E NAD 0.0001829 0.4395 9.26518
431 1KEV NDP 0.0002587 0.40031 9.26518
432 1IUP ALQ 0.001071 0.4087 9.57447
433 2V6O FAD 0.001007 0.44618 9.58466
434 1OBB NAD 0.0004351 0.43751 9.58466
435 1CER NAD 0.0004359 0.42543 9.58466
436 1TUF AZ1 0.001036 0.40128 9.58466
437 3LTW HLZ 0.01769 0.40715 9.64286
438 1V8B NAD 0.00008304 0.49304 9.90415
439 4PVD NDP 0.0004394 0.44896 9.90415
440 4L8V NAP 0.0007852 0.44321 9.90415
441 1UP7 NAD 0.0006039 0.44158 9.90415
442 3RKR NAP 0.0008338 0.47186 9.92366
443 4K30 NLG 0.0128 0.40346 10
444 1YOA FMN 0.02481 0.43273 10.0629
445 2NU8 COA 0.0002613 0.43578 10.0694
446 3AFN NAP 0.0005986 0.4524 10.0775
447 1F06 NDP 0.0005082 0.45677 10.2236
448 1Z82 NDP 0.0005223 0.41724 10.4478
449 2G50 PYR 0.009854 0.42578 10.5431
450 1NYT NAP 0.0008433 0.42189 10.7011
451 2V6G NAP 0.0005542 0.451 10.8626
452 3DGB MUC 0.005743 0.40422 10.8626
453 2NAD NAD 0.0002895 0.4685 11.1821
454 1FEC FAD 0.008205 0.41708 11.1821
455 1MXH DHF 0.011 0.40415 11.2319
456 1MXH NAP 0.01272 0.40142 11.2319
457 3PVT 3HC 0.001184 0.41636 11.254
458 3O94 NCA 0.02501 0.4044 11.3744
459 1GR0 NAD 0.0003721 0.46252 11.5016
460 3L4S NAD 0.001998 0.42895 11.5016
461 3L4S 3PG 0.002143 0.42895 11.5016
462 4R1S NAP 0.0008427 0.41589 11.5016
463 1G0N NDP 0.0003153 0.47075 11.6608
464 1G0N PHH 0.0004811 0.46631 11.6608
465 3SHR CMP 0.0008704 0.44123 11.7057
466 3UCL CYH 0.02279 0.40821 12.1406
467 3UCL NAP 0.02976 0.40452 12.1406
468 3QV1 NAD 0.001683 0.40481 12.1951
469 1ZK4 AC0 0.0001085 0.48486 12.3506
470 1ZK4 NAP 0.001285 0.44211 12.3506
471 1CF2 NAP 0.0002441 0.45948 12.4601
472 3JQ9 NAP 0.008126 0.40073 12.5
473 3QDY CBS 0.008824 0.4269 12.5874
474 3QDY A2G GAL 0.01945 0.41657 12.5874
475 3QDT A2G GAL 0.02724 0.40934 12.5874
476 1I7Q PYR 0.005874 0.44531 12.9534
477 1NVM NAD 0.0000222 0.44946 13.141
478 4AF0 IMP 0.004838 0.40542 13.4185
479 2WD7 NAP 0.006442 0.40364 13.4328
480 3U4C NDP 0.002578 0.42022 13.5231
481 1MV8 NAD 0.0003987 0.4507 13.738
482 1MUU NAD 0.0005951 0.42711 13.738
483 1MUU SUC 0.03327 0.41536 13.738
484 1QO0 BMD 0.00357 0.43879 13.7755
485 1PTR PRB 0.02731 0.40352 14
486 1GU3 BGC BGC BGC BGC BGC 0.01334 0.4027 14.094
487 1P77 ATR 0.0006591 0.48897 14.3382
488 1X14 NAD 0.004073 0.42117 14.6965
489 1QD0 RR6 0.001923 0.42259 14.8438
490 2HK9 NAP 0.0004761 0.44752 15.016
491 2G86 UMP 0.002901 0.41405 15.016
492 2HK9 ATR 0.0001432 0.41117 15.016
493 2GLX NDP 0.0004728 0.43628 15.3355
494 1MXI SAH 0.002569 0.40102 15.625
495 4KOA NDP 0.0009136 0.45032 15.655
496 1BZL FAD 0.01163 0.43471 15.655
497 1VL0 NAI 0.0003927 0.44925 16.0959
498 1Y75 NAG 0.003906 0.42015 16.9492
499 1ECM TSA 0.002796 0.42612 17.4312
500 4GYW UDP 0.002315 0.40182 17.5719
501 1Z6Z NAP 0.0004278 0.45423 17.7305
502 3BY8 MLT 0.00411 0.44255 18.3099
503 3SJ7 NDP 0.0001474 0.47193 18.6508
504 1RKX NAD 0.00006392 0.43479 18.8498
505 1BTN I3P 0.003121 0.49379 19.8113
506 4WNB 4BN 0.0001478 0.40375 20.3209
507 1RP0 AHZ 0.005761 0.40953 21.831
508 2E1A MSE 0.001498 0.43725 24
509 1RM4 NDP 0.002049 0.42291 25.8786
510 1UO5 PIH 0.006787 0.46433 29.4118
511 2JAP NDP 0.0000961 0.42875 29.9595
512 3RF4 FUN 0.000705 0.45688 30.1724
513 1LNX URI 0.002153 0.43634 32.0988
514 1B8U OAA 0.00001469 0.51888 36.7412
515 1B8U NAD 0.000003335 0.51749 36.7412
516 3P3N AKG 0.0134 0.41266 40
517 4MDH NAD 0.000000002855 0.60785 41.2141
518 5MDH NAD 0.000000005898 0.59668 41.2141
519 2CVQ NDP 0.000006288 0.48089 41.2844
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