Receptor
PDB id Resolution Class Description Source Keywords
3ICC 1.87 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF A PUTATIVE 3-OXOACYL-(ACYL CARRIER PROT REDUCTASE FROM BACILLUS ANTHRACIS AT 1.87 A RESOLUTION BACILLUS ANTHRACIS STR. -prime AMES ANCESTORORGANISM_COMMON: ANTHRAX BACTERIUM STRUCTURAL GENOMICS PUTATIVE 3-OXOACYL-(ACYL CARRIER PROTEIREDUCTASE OXIDOREDUCTASE CENTER FOR STRUCTURAL GENOMICS OINFECTIOUS DISEASES CSGID
Ref.: STRUCTURE OF A SHORT-CHAIN DEHYDROGENASE/REDUCTASE BACILLUS ANTHRACIS. ACTA CRYSTALLOGR.,SECT.F V. 68 632 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:292;
A:293;
B:291;
B:294;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
35.453 Cl [Cl-]
MES B:401;
Invalid;
none;
submit data
195.237 C6 H13 N O4 S C1COC...
NAP A:300;
B:300;
Valid;
Valid;
none;
none;
submit data
743.405 C21 H28 N7 O17 P3 c1cc(...
SO4 A:402;
A:404;
B:403;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3ICC 1.87 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF A PUTATIVE 3-OXOACYL-(ACYL CARRIER PROT REDUCTASE FROM BACILLUS ANTHRACIS AT 1.87 A RESOLUTION BACILLUS ANTHRACIS STR. -prime AMES ANCESTORORGANISM_COMMON: ANTHRAX BACTERIUM STRUCTURAL GENOMICS PUTATIVE 3-OXOACYL-(ACYL CARRIER PROTEIREDUCTASE OXIDOREDUCTASE CENTER FOR STRUCTURAL GENOMICS OINFECTIOUS DISEASES CSGID
Ref.: STRUCTURE OF A SHORT-CHAIN DEHYDROGENASE/REDUCTASE BACILLUS ANTHRACIS. ACTA CRYSTALLOGR.,SECT.F V. 68 632 2012
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 3ICC - 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 1068 families.
1 3ICC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50% Homology Family (89)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 177 families.
1 1E6W - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 1VL8 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
3 3A28 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 1X7G - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
5 2RH4 Ki = 15 uM EMO C15 H10 O5 Cc1cc2c(c(....
6 2RHR - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
7 3RI3 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
8 2RHC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
9 1Q7B Kd = 3.5 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
10 1Q7C - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
11 1GEG - GLC C6 H12 O6 C([C@@H]1[....
12 3VZS - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
13 4N5N - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
14 4QEC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
15 4QED - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
16 3AY6 - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
17 3AUU - BGC C6 H12 O6 C([C@@H]1[....
18 3AUT - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
19 4BNT ic50 = 137.69 uM 36E C8 H5 F3 N2 c1ccc2c(c1....
20 4BNY ic50 = 0.08 uM 36I C16 H15 N3 O S c1ccc(cc1)....
21 4BNV ic50 = 0.03 uM Q7U C15 H13 Cl N4 O Cn1c2ccccc....
22 4BO1 ic50 = 0.05 uM NKH C18 H15 Cl N2 O3 COc1cc(c(c....
23 4AG3 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
24 4BO2 ic50 = 0.05 uM 36K C17 H18 N4 O2 CCn1c2cccc....
25 4BNX ic50 = 0.02 uM O74 C20 H14 Cl N3 O c1ccc2c(c1....
26 4BNU ic50 = 0.02 uM 9KQ C16 H11 N5 c1ccc(cc1)....
27 4BO3 ic50 = 0.3 uM U98 C12 H10 F3 N3 O2 S c1cc(cc(c1....
28 4NBT - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
29 1H5Q - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
30 1IPE - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
31 1IPF - TNE C8 H13 N O CN1[C@H]2C....
32 1U7T Ki = 425 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
33 1NFF - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
34 1NFR - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
35 1XKQ - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
36 2ZAT - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
37 1O5I - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
38 2ZTL - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
39 2ZTU - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
40 2ZTM - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
41 5EN4 Ki = 64 nM 5Q6 C18 H12 F N O4 c1cc(c(c(c....
42 5L7T Ki = 26 nM 6QJ C19 H14 F N O3 Cc1cc(ccc1....
43 5L7W Ki = 11 nM 6QU C18 H11 F2 N O4 c1cc(c(c(c....
44 5ICM - GLC C6 H12 O6 C([C@@H]1[....
45 5JS6 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
46 5JSF - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
47 1ZK4 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
48 1ZK0 - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
49 1ZJZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
50 1ZJY - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
51 3LQF - MRY C4 H10 O4 C([C@H]([C....
52 2WDZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
53 4NBW - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
54 1DOH Ki = 2.4 nM NID C9 H5 N O3 c1cc2c(c(c....
55 4GH5 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
56 1CYD - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
57 1RWB - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
58 1G6K - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
59 1GEE - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
60 5EPO - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
61 4URE - 1PS C8 H11 N O3 S c1cc[n+](c....
62 4URF - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
63 4KWI - 1TJ C19 H12 O5 Cc1cc2c(c(....
64 4FN4 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
65 2CFC - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
66 3ICC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
67 1UAY - ADN C10 H13 N5 O4 c1nc(c2c(n....
68 2B4Q - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
69 1IY8 Ki = 23.8 mM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70 4CR7 - MAN C6 H12 O6 C([C@@H]1[....
71 5ITV - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
72 1AHI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
73 1FMC - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
74 5B4T - 3HR C4 H8 O3 C[C@H](CC(....
75 5FFF ic50 = 425 uM 5XC C8 H6 O3 c1cc2c(cc1....
76 3O03 - GCO C6 H12 O7 C([C@H]([C....
77 2DTX - BMA C6 H12 O6 C([C@@H]1[....
78 5FEU - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
79 2AG5 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
80 1JA9 Ki = 420 nM PYQ C11 H11 N O c1cc2c3c(c....
81 1AE1 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
82 1PR9 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
83 1WNT - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
84 2BGM - NAJ C21 H27 N7 O14 P2 c1cc(c[n+]....
85 2GDZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
86 1UZN Kd = 11.2 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
87 1HDC Ki = 1 uM CBO C34 H50 O7 CC1([C@@H]....
88 3QWI ic50 = 2.8 uM CUE C15 H8 O5 c1cc2c(cc1....
89 1XHL - TNE C8 H13 N O CN1[C@H]2C....
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 : 3ICC; Ligand: NAP; Similar sites found: 680
This union binding pocket(no: 1) in the query (biounit: 3icc.bio1) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1BTN I3P 0.00009283 0.59044 None
2 2XI7 XI7 0.0007333 0.53098 None
3 1UW1 ADP 0.0009776 0.46983 None
4 1PTR PRB 0.0047 0.45121 None
5 1UO5 PIH 0.01936 0.44922 None
6 1ECM TSA 0.004382 0.42956 None
7 2ZSC BTN 0.002097 0.42849 None
8 1Q3P GLU ALA GLN THR ARG LEU 0.004648 0.42847 None
9 1QD0 RR6 0.002908 0.42739 None
10 4P9Z NMI PTR 02K ASN NH2 0.01195 0.41549 None
11 2FR6 URI 0.003165 0.40957 None
12 6FIV 3TL 0.006953 0.4081 None
13 1Z6K OAA 0.01084 0.40636 None
14 2FR6 CTN 0.003968 0.40602 None
15 1POC GEL 0.005793 0.4036 None
16 2Q09 DI6 0.01974 0.40157 None
17 3D2Y AH0 ALA FGA LYS 0.002357 0.4142 0.784314
18 1QH9 LAC 0.0003996 0.49505 0.862069
19 1Y1A GSH 0.02404 0.44906 1.0929
20 1CKM GTP 0.00165 0.44766 1.17647
21 4C6F DOR 0.005664 0.42013 1.17647
22 4C6F NCD 0.005664 0.42013 1.17647
23 3ZF8 GDP 0.008821 0.41214 1.17647
24 1TV5 N8E 0.004194 0.40515 1.17647
25 1TV5 ORO 0.006871 0.40264 1.17647
26 1JN2 SFP 0.001206 0.52913 1.26582
27 2ORV 4TA 0.001013 0.40889 1.28205
28 4B16 NAG 0.0001946 0.55057 1.56863
29 3VPH NAD 0.0003483 0.43574 1.56863
30 3KB6 NAD 0.0003759 0.41987 1.56863
31 3VPH OXM 0.001185 0.41864 1.56863
32 1T0I FMN 0.0006315 0.43486 1.57068
33 1JH7 UVC 0.009233 0.4255 1.5873
34 2IYG FMN 0.01281 0.40143 1.6129
35 1YRX FMN 0.004842 0.41426 1.65289
36 1Q6O LG6 0.007755 0.40247 1.85185
37 3LU1 NAD 0.00000002293 0.59914 1.96078
38 1SB8 UD2 0.0000001134 0.59334 1.96078
39 1SB8 NAD 0.0000001677 0.58131 1.96078
40 1EK6 UPG 0.000001631 0.55115 1.96078
41 2YY7 NAD 0.0000001924 0.54965 1.96078
42 2BO4 FLC 0.006028 0.44595 1.96078
43 1BW9 NAD 0.001331 0.43985 1.96078
44 2DWU DGL 0.002982 0.43669 1.96078
45 3MCT SAH 0.0004576 0.4314 1.96078
46 3MCT 3MC 0.005451 0.43053 1.96078
47 1C1X NAD 0.001203 0.42856 1.96078
48 3MAG SAH 0.0009761 0.42397 1.96078
49 3SIX GDP 0.003882 0.42234 1.96078
50 4R5M NAP 0.001297 0.42139 1.96078
51 4OYA 1VE 0.003323 0.41614 1.96078
52 4R5M 4NO 0.001803 0.41057 1.96078
53 2VE3 REA 0.02454 0.40963 1.96078
54 3EE4 MYR 0.002201 0.40796 1.96078
55 3KL3 GCU 0.03823 0.40192 1.96078
56 4G28 0W8 0.001397 0.45074 2.01342
57 1B5E DCM 0.0005664 0.46746 2.03252
58 1AX2 NDG GAL 0.0003689 0.48197 2.09205
59 2Q37 3AL 0.0005167 0.4824 2.20994
60 3CH5 GDP 0.006443 0.41348 2.31481
61 3KO8 NAD 0.00000001725 0.59264 2.35294
62 1OC2 NAD 0.000002254 0.54557 2.35294
63 1KEW TYD 0.000001823 0.54344 2.35294
64 1KEW NAD 0.000002753 0.53761 2.35294
65 1BXK NAD 0.0000002499 0.53678 2.35294
66 3U1T MLI 0.0006341 0.49354 2.35294
67 4OOE NDP 0.0002291 0.45734 2.35294
68 3LTW HLZ 0.004142 0.44736 2.35294
69 3V1V GST 0.0004068 0.44637 2.35294
70 2Z9V PXM 0.003037 0.44171 2.35294
71 4ZRN NAD 0.002414 0.42834 2.35294
72 4MP8 MLI 0.00000628 0.42771 2.35294
73 3JV7 NAD 0.0007796 0.42702 2.35294
74 2PUL ACP 0.001897 0.42577 2.35294
75 1O0S NAI 0.002459 0.42514 2.35294
76 1UF5 CDT 0.006443 0.4178 2.35294
77 1AUA BOG 0.01192 0.41554 2.35294
78 1PX8 XYP 0.01627 0.41427 2.35294
79 1CBF SAH 0.003866 0.414 2.35294
80 2EJU SAH 0.002437 0.41368 2.35294
81 2NLI LAC 0.001011 0.41353 2.35294
82 3QO8 SSA 0.004131 0.4129 2.35294
83 1PZG A3D 0.0003975 0.41221 2.35294
84 1MUU NAD 0.00435 0.40894 2.35294
85 2NAD NAD 0.002244 0.40829 2.35294
86 4NEC SAH 0.01966 0.40728 2.35294
87 1VKO NAD 0.001937 0.4069 2.35294
88 3E1T FAD 0.004735 0.40442 2.35294
89 1K6M AGS 0.002989 0.40339 2.35294
90 1ZMD NAI 0.007287 0.40246 2.35294
91 3H9E NAD 0.001201 0.40131 2.35294
92 2NLI FMN 0.002269 0.40127 2.35294
93 1CF2 NAP 0.001125 0.40124 2.35294
94 1W2D ADP 0.03645 0.40077 2.35294
95 3TWO NDP 0.003696 0.4002 2.35294
96 1QPB PYM 0.001202 0.40017 2.35294
97 1B74 DGN 0.004629 0.4586 2.3622
98 2IF8 ADP 0.04174 0.40513 2.47934
99 2DC1 NAD 0.0007797 0.40993 2.54237
100 1Y9Q MED 0.01066 0.42803 2.60417
101 1EJE FMN 0.002026 0.41657 2.60417
102 1XIU REA 0.005286 0.40508 2.6087
103 4AF5 CIT 0.0008627 0.47936 2.63158
104 2GJN NIS 0.0006666 0.40482 2.7439
105 2GJN FMN 0.001152 0.40386 2.7439
106 1UDB NAD 0.0000003341 0.57359 2.7451
107 4PIV NDP 0.000000385 0.53898 2.7451
108 2OWZ CIT 0.0009026 0.47844 2.7451
109 1KTC NGA 0.0005089 0.47583 2.7451
110 2Q3M MLA 0.005012 0.4646 2.7451
111 1FP2 SAH 0.0002596 0.46396 2.7451
112 2YVF FAD 0.00005039 0.45429 2.7451
113 2YVF NAD 0.00005382 0.45429 2.7451
114 2B7N NTM 0.004032 0.44188 2.7451
115 2Q8M AMP 0.001306 0.44138 2.7451
116 1SOW NAD 0.0002331 0.44073 2.7451
117 2I3G NAP 0.0002892 0.44029 2.7451
118 2F2U M77 0.002023 0.43865 2.7451
119 3ZUY TCH 0.002078 0.43817 2.7451
120 4DEC UDP 0.00007639 0.43673 2.7451
121 4DEC 3PG 0.00007639 0.43673 2.7451
122 1RYD GLC 0.007978 0.43396 2.7451
123 3A06 FOM 0.0004976 0.43396 2.7451
124 1VDC FAD 0.0001091 0.43358 2.7451
125 3A06 NDP 0.0004512 0.43295 2.7451
126 3B1J NAD 0.0005607 0.43246 2.7451
127 3GFB NAD 0.0008171 0.43216 2.7451
128 2ZJ5 ADP 0.006733 0.43175 2.7451
129 1I2L DCS 0.0006119 0.43111 2.7451
130 1W7J ADP BEF 0.001322 0.4274 2.7451
131 1O68 KIV 0.006998 0.42575 2.7451
132 1WDA BAG 0.005389 0.42572 2.7451
133 1UDB UFG 0.00000007073 0.42195 2.7451
134 3OCZ SRA 0.002616 0.41641 2.7451
135 1FP2 HMO 0.003429 0.41598 2.7451
136 1U1I NAD 0.001322 0.41562 2.7451
137 1NNS ASP 0.007478 0.41512 2.7451
138 2WUF KEM 0.0008442 0.41489 2.7451
139 1A59 CIT 0.027 0.41407 2.7451
140 1EB9 HBA 0.007084 0.41182 2.7451
141 1YQZ FAD 0.005956 0.41177 2.7451
142 1A8S PPI 0.009149 0.40938 2.7451
143 1YKJ FAD 0.007862 0.40893 2.7451
144 2R42 FPS 0.009585 0.40887 2.7451
145 1A59 COA 0.00337 0.40859 2.7451
146 1KYZ FER 0.000659 0.40497 2.7451
147 3LST SAH 0.02225 0.40464 2.7451
148 2DDH HXD 0.002864 0.40403 2.7451
149 1XX4 BAM 0.02479 0.40362 2.7451
150 1HYE NAP 0.0004085 0.40314 2.7451
151 1SG4 CO8 0.000971 0.40301 2.7451
152 4Q0A 4OA 0.005002 0.40238 2.7451
153 1Z4V DAN 0.01264 0.40166 2.7451
154 4E13 NAD 0.0002693 0.40155 2.7451
155 2R14 FMN 0.001138 0.4009 2.7451
156 4JEJ 1GP 0.001647 0.43733 2.86885
157 2WGC SIA GAL BGC 0.03466 0.43452 2.92398
158 2V5E SCR 0.001272 0.50591 3
159 2YCD GTB 0.0121 0.40242 3.04348
160 4M5P MLA 0.0001509 0.55662 3.13725
161 2Q8H TF4 0.001759 0.4885 3.13725
162 1O9U ADZ 0.003489 0.47287 3.13725
163 2GZ3 NAP 0.0003663 0.45228 3.13725
164 2VAR KDG 0.000896 0.44796 3.13725
165 2VAR KDF 0.001037 0.4454 3.13725
166 2PV7 NAD 0.0004654 0.44176 3.13725
167 1E5Q NDP 0.0005119 0.437 3.13725
168 2VAR AMP 0.002268 0.43659 3.13725
169 1YBH P22 0.002421 0.43542 3.13725
170 4M5P 23W 0.01457 0.43337 3.13725
171 2PP3 LGT 0.001874 0.4304 3.13725
172 1E5F PLP 0.001539 0.42924 3.13725
173 4NM5 ADP 0.0005744 0.4241 3.13725
174 1IG3 VIB 0.0001014 0.42216 3.13725
175 4IHQ ADP 0.007557 0.41945 3.13725
176 4KCF AKM 0.0004084 0.41858 3.13725
177 4TO8 FLC 0.04537 0.41832 3.13725
178 3B1F NAD 0.0002 0.41408 3.13725
179 2GSD NAD 0.001861 0.41132 3.13725
180 1ZED PNP 0.03104 0.41109 3.13725
181 1QF5 RPL 0.0006484 0.41072 3.13725
182 1QF5 GDP 0.0006484 0.41072 3.13725
183 1OYB HBA 0.0007512 0.40641 3.13725
184 3B96 MYA 0.003256 0.40554 3.13725
185 3AYS CT3 0.01451 0.40315 3.13725
186 1KOL NAD 0.003471 0.40236 3.13725
187 4Q3S X7A 0.001454 0.4007 3.13725
188 1XX6 ADP 0.003832 0.42716 3.14136
189 1KYV RBF 0.001322 0.4274 3.14465
190 3MJE NDP 0.0000000005603 0.63494 3.22581
191 1C3V PDC 0.009299 0.42536 3.26531
192 1C3V NDP 0.003182 0.40134 3.26531
193 1U3I GSH 0.01251 0.41948 3.31754
194 4M4Q 21A 0.0006149 0.41582 3.3195
195 4U9W SER GLY ARG GLY LYS NH2 0.01653 0.41644 3.38164
196 4U9W COA 0.003057 0.4139 3.38164
197 1HDO NAP 0.000003538 0.49666 3.39806
198 3I8P 840 0.001779 0.42683 3.51288
199 4EUE NAI 0.0000001047 0.56383 3.52941
200 1R6D NAD 0.000000762 0.56195 3.52941
201 1R6D DAU 0.000001775 0.54628 3.52941
202 2X6T NAP 0.0000003737 0.53427 3.52941
203 1EQ2 NAP 0.0000008634 0.5209 3.52941
204 1DXY COI 0.000856 0.50493 3.52941
205 2HJR APR 0.00006133 0.49273 3.52941
206 3ULK NDP 0.000006646 0.48902 3.52941
207 1T3D CYS 0.002415 0.46529 3.52941
208 3TKA CTN 0.01421 0.45618 3.52941
209 1P72 THM 0.001779 0.45193 3.52941
210 1Y42 TYR 0.00238 0.44638 3.52941
211 3JQ3 ADP 0.002036 0.43854 3.52941
212 3CIF NAD 0.0002392 0.43201 3.52941
213 4EPL JAI 0.001871 0.426 3.52941
214 3TKA SAM 0.000951 0.42048 3.52941
215 3DGB MUC 0.004403 0.42014 3.52941
216 1H2B NAJ 0.0008259 0.41634 3.52941
217 2VHW NAI 0.001801 0.41304 3.52941
218 3CIF G3H 0.002265 0.40814 3.52941
219 1U3U BNF 0.004975 0.40265 3.52941
220 4IMG NGF 0.004582 0.40031 3.52941
221 3UOY NAP 0.01473 0.40031 3.52941
222 2NXE SAM 0.01736 0.40022 3.54331
223 1B55 4IP 0.001582 0.43327 3.5503
224 1B4P GPS 0.0009848 0.42789 3.68664
225 3O7B SAH 0.0005897 0.43593 3.68852
226 2QTR NXX 0.0001583 0.41338 3.7037
227 4LN7 1ZQ 0.004443 0.40788 3.82775
228 5GVR LMR 0.02714 0.41328 3.84615
229 3PNA CMP 0.00612 0.42336 3.8961
230 1E7S NAP 0.0000001144 0.56242 3.92157
231 1GY8 NAD 0.0000001786 0.55075 3.92157
232 2V6G NAP 0.0000001973 0.54954 3.92157
233 1N7G NDP 0.000006162 0.53961 3.92157
234 1N7G GDR 0.00000634 0.52774 3.92157
235 3ZPG 5GP 0.001327 0.49494 3.92157
236 3A1I UNU 0.0002343 0.47739 3.92157
237 4USS GSH 0.001306 0.45784 3.92157
238 3I0O SMI 0.002379 0.45229 3.92157
239 2CE7 ADP 0.0008748 0.44334 3.92157
240 4KOA NDP 0.003428 0.43616 3.92157
241 1UOU CMU 0.001448 0.43478 3.92157
242 2JFV FLC 0.007827 0.43435 3.92157
243 3M6W SAM 0.001327 0.43169 3.92157
244 4NAO AKG 0.01236 0.43071 3.92157
245 3SHR CMP 0.003256 0.43009 3.92157
246 1R6W 164 0.001726 0.42734 3.92157
247 3GGO NAI 0.001308 0.42386 3.92157
248 2B4R NAD 0.0006129 0.42272 3.92157
249 3I0O ADP 0.004977 0.42245 3.92157
250 1VJO PLP 0.00242 0.42175 3.92157
251 4AMV F6R 0.00269 0.42 3.92157
252 5T4J PLP ABU 0.004531 0.41539 3.92157
253 2NZ2 ASP 0.01444 0.41185 3.92157
254 4PNI KQQ 0.0008881 0.41071 3.92157
255 3L4S NAD 0.001594 0.41001 3.92157
256 1H0C AOA 0.03286 0.40986 3.92157
257 3L4S 3PG 0.001754 0.40979 3.92157
258 1LLU NAD 0.0009989 0.40975 3.92157
259 1NVM NAD 0.002312 0.40653 3.92157
260 2B4R AES 0.001479 0.4063 3.92157
261 1RM4 NDP 0.001069 0.40589 3.92157
262 2G5C NAD 0.001084 0.40558 3.92157
263 1QZZ SAM 0.008359 0.40496 3.92157
264 1MOQ GLP 0.005053 0.40222 3.92157
265 1WDK NAD 0.0006368 0.40009 3.92157
266 1QR0 COA 0.0005947 0.46065 3.94737
267 1QDS PGA 0.002341 0.43602 3.98406
268 4COQ SAN 0.002102 0.4612 4.04858
269 2BES RES 0.004565 0.41951 4.06977
270 2Y7P SAL 0.002714 0.44386 4.12844
271 4JCA CIT 0.000197 0.55028 4.19162
272 1L2T ATP 0.001394 0.40775 4.25532
273 3E81 SLB 0.00381 0.443 4.26829
274 1ZJ6 G3D 0.004093 0.42142 4.27807
275 3A4V NAD 0.0000001918 0.56176 4.31373
276 4HZO COA 0.0003262 0.48432 4.31373
277 2HFK E4H 0.0005954 0.47283 4.31373
278 2F1K NAP 0.0003148 0.45182 4.31373
279 4MDH NAD 0.0003234 0.44797 4.31373
280 4CCO OGA 0.002318 0.44688 4.31373
281 4CCN OGA 0.004771 0.44447 4.31373
282 1EZ4 NAD 0.0005201 0.44311 4.31373
283 2NVK NAP 0.003896 0.43696 4.31373
284 5MDH NAD 0.0001634 0.43136 4.31373
285 4OB6 S2T 0.001458 0.43013 4.31373
286 2GWD GLU 0.005854 0.42419 4.31373
287 3V91 UPG 0.0005735 0.42413 4.31373
288 1WNG SAH 0.001513 0.41727 4.31373
289 3P0F BAU 0.004008 0.4134 4.31373
290 2Q28 ADP 0.001968 0.41324 4.31373
291 2FZW NAD 0.002906 0.41258 4.31373
292 1YB5 NAP 0.001621 0.41232 4.31373
293 2OHV NHL 0.01218 0.41057 4.31373
294 2RCN GDP 0.009963 0.40994 4.31373
295 2NXW TPP 0.000186 0.40831 4.31373
296 1R27 MGD 0.0004495 0.4032 4.31373
297 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.0008029 0.40081 4.31373
298 1LYX PGA 0.0000471 0.49293 4.43548
299 3AB4 THR 0.02082 0.41726 4.49438
300 2BZ1 TAU 0.01575 0.4544 4.59184
301 1NN5 2DT 0.00009253 0.41157 4.65116
302 1NN5 ANP 0.00009253 0.41157 4.65116
303 1L3I SAH 0.0002782 0.41959 4.6875
304 1ORR NAD 0.00000002827 0.58687 4.70588
305 2Q1W NAD 0.0000008861 0.52973 4.70588
306 2Q1S NAI 0.000006459 0.51457 4.70588
307 2PZM NAD 0.00002553 0.49163 4.70588
308 4WVH ASP HIS ASP ALA HIS ALA 0.0005576 0.46774 4.70588
309 3L6R MLI 0.003347 0.45839 4.70588
310 4B7E OGA 0.00222 0.45365 4.70588
311 3PMA SCR 0.002256 0.4474 4.70588
312 4PLG NAI 0.0002852 0.4443 4.70588
313 3P3N AKG 0.004881 0.444 4.70588
314 1HYH NAD 0.0007745 0.42429 4.70588
315 2R5T ANP 0.0007798 0.42345 4.70588
316 2CVQ NDP 0.0006958 0.41398 4.70588
317 1EYE PMM 0.007275 0.41135 4.70588
318 2WA4 069 0.007549 0.4107 4.70588
319 2AHR NAP 0.0003036 0.40855 4.70588
320 3CEV ARG 0.01541 0.40619 4.70588
321 1D09 PAL 0.009421 0.40364 4.70588
322 2DT5 NAD 0.001437 0.41968 4.73934
323 3EGV SAH 0.01386 0.40787 4.7619
324 3F81 STT 0.02475 0.42006 4.91803
325 3BY8 MLT 0.001987 0.46942 4.92958
326 5BWD FUM 0.02388 0.44627 5
327 3I6B KDO 0.01328 0.41346 5
328 3NOJ PYR 0.003791 0.44023 5.04202
329 3RK0 AMP 0.003481 0.42425 5.06329
330 1JGS SAL 0.002959 0.49621 5.07246
331 1KDK DHT 0.001045 0.41539 5.08475
332 4GLL NAD 0.0000001827 0.55495 5.09804
333 2C29 NAP 0.000001175 0.54301 5.09804
334 1VL0 NAI 0.0000001034 0.5328 5.09804
335 4B9E FAH 0.0001546 0.52335 5.09804
336 2C29 DQH 0.000003829 0.52329 5.09804
337 3SQG COM 0.003971 0.4788 5.09804
338 2YIV YIV 0.003278 0.46618 5.09804
339 2ZWS PLM 0.01394 0.45746 5.09804
340 1RZM PEP 0.001604 0.45391 5.09804
341 3V1Y NAD 0.0003952 0.44788 5.09804
342 2QF7 COA 0.0006968 0.4472 5.09804
343 1SQ5 PAU 0.003385 0.43964 5.09804
344 3BAZ NAP 0.0008892 0.437 5.09804
345 3NFZ 3NF 0.002268 0.43173 5.09804
346 5F5N NAD 0.005383 0.43077 5.09804
347 1RZM E4P 0.01374 0.42847 5.09804
348 1UWK URO 0.001648 0.424 5.09804
349 3WLE NAD 0.00122 0.41937 5.09804
350 1SQ5 ADP 0.006448 0.41346 5.09804
351 1GAD NAD 0.0008013 0.40806 5.09804
352 3SQG TP7 0.005884 0.40704 5.09804
353 2YIV NBN 0.03825 0.4066 5.09804
354 4L7I SAM 0.005715 0.40382 5.09804
355 1EP2 FMN 0.0007614 0.4031 5.09804
356 1LC8 33P 0.000987 0.40279 5.09804
357 1MZV AMP 0.005451 0.42081 5.10638
358 2FH5 GTP 0.0003382 0.44018 5.14019
359 1JAC AMG 0.006557 0.46684 5.26316
360 1JOT GAL A2G 0.01705 0.40023 5.26316
361 1V7R CIT 0.00955 0.45786 5.37634
362 4PVD NDP 0.00000004892 0.54897 5.4902
363 3ZGE ASP 0.002609 0.47119 5.4902
364 2VDJ HSE 0.004461 0.45941 5.4902
365 2JL1 NAP 0.00003602 0.4389 5.4902
366 4KCT FDP 0.001888 0.43494 5.4902
367 3BK2 U5P 0.00279 0.42811 5.4902
368 2QCX PF1 0.009087 0.42582 5.4902
369 3T1A 5MA 0.001171 0.42518 5.4902
370 3MD0 GDP 0.005866 0.42415 5.4902
371 3PC3 P1T 0.0009367 0.42071 5.4902
372 2DFV NAD 0.0003907 0.41983 5.4902
373 1QS8 IVA VAL VAL STA ALA STA 0.000797 0.41934 5.4902
374 2C2A ADP 0.002281 0.41862 5.4902
375 3T31 DCQ 0.003784 0.41821 5.4902
376 3T31 FAD 0.003466 0.41821 5.4902
377 3I6I NDP 0.0002223 0.41808 5.4902
378 3I51 45C 0.006677 0.41285 5.4902
379 1WP4 NDP 0.0007746 0.41002 5.4902
380 1YHM AHD 0.02313 0.40727 5.4902
381 3HAZ NAD 0.0003633 0.40633 5.4902
382 4KCT PYR 0.01534 0.40627 5.4902
383 3W54 RNB 0.01018 0.40161 5.4902
384 4HA6 PXM 0.03166 0.40099 5.4902
385 5EQU AKG 0.0192 0.42727 5.57377
386 1VQ2 DDN 0.002266 0.41873 5.69948
387 1IM8 SAI 0.00006632 0.46021 5.7377
388 3T2W BTN 0.01282 0.40539 5.7377
389 1CER NAD 0.000229 0.45735 5.74018
390 2JBH 5GP 0.0003787 0.4749 5.77778
391 1DBT U5P 0.000128 0.45989 5.85774
392 1Z45 NAD 0.00000003448 0.59241 5.88235
393 3RFV NAI 0.0000002107 0.53536 5.88235
394 1WVG APR 0.0000008995 0.50222 5.88235
395 3RFV 15L 0.00001049 0.47074 5.88235
396 3MTW M3R 0.0005049 0.44765 5.88235
397 3QV9 QV7 0.003215 0.44635 5.88235
398 1Z45 GAL 0.003164 0.44093 5.88235
399 4LIT AKG 0.004544 0.43952 5.88235
400 3CMC NAD 0.002033 0.43474 5.88235
401 1Z45 UPG 0.000955 0.42837 5.88235
402 4TSK NDP 0.0004671 0.42215 5.88235
403 4E5N NAD 0.0007141 0.42032 5.88235
404 2ZJF BSU 0.007093 0.41607 5.88235
405 1DSS NAD 0.0004444 0.41269 5.88235
406 4EPM AMP 0.001193 0.40996 5.88235
407 4DYO SD4 0.01374 0.40833 5.88235
408 2DBZ NAP 0.0005184 0.41906 5.98802
409 3QP4 HL0 0.006612 0.40511 6.04396
410 5RHN 8BR 0.006621 0.40509 6.08696
411 2BOI MFU 0.007494 0.42444 6.19469
412 1S8F GDP 0.001164 0.43849 6.21469
413 1RKX NAD 0.00000002748 0.59059 6.27451
414 2XDQ MGX 0.001667 0.48973 6.27451
415 2W8Q SIN 0.002144 0.46781 6.27451
416 1E4E PHY 0.0001854 0.46421 6.27451
417 1UXG FUM 0.00000439 0.4626 6.27451
418 2P69 PLP 0.001723 0.45865 6.27451
419 1UXG NAD 0.000155 0.45554 6.27451
420 1GJW GLC 0.005228 0.44896 6.27451
421 1Z42 HBA 0.02292 0.44024 6.27451
422 2QJN KDG 0.001881 0.43033 6.27451
423 1GJW MAL 0.003746 0.42757 6.27451
424 2IXB NAD 0.0006821 0.42636 6.27451
425 1Y1P NMN AMP PO4 0.01064 0.42533 6.27451
426 1FBL HTA 0.004853 0.42291 6.27451
427 4C2G ALA ALA ALA ALA 0.006796 0.42142 6.27451
428 3DG6 MUC 0.003239 0.4211 6.27451
429 3GE7 AFQ 0.0001894 0.40956 6.27451
430 4WB7 ATP 0.009089 0.40547 6.27451
431 1Z48 FMN 0.007853 0.40226 6.27451
432 3LZW NAP 0.01087 0.40059 6.27451
433 3LZW FAD 0.004544 0.40014 6.27451
434 4PTZ FMN 0.004235 0.405 6.28272
435 1H8G CHT 0.01328 0.45869 6.31579
436 1Y2W NAG 0.01795 0.41733 6.33803
437 2VQ5 LDP 0.004306 0.46807 6.46766
438 2VQ5 HBA 0.005478 0.44797 6.46766
439 1G8S MET 0.003227 0.45245 6.52174
440 1SS4 CIT 0.000002827 0.70544 6.53595
441 1SS4 GSH 0.0005729 0.55108 6.53595
442 1V35 NAI 0.000000228 0.56731 6.66667
443 2EB5 OXL 0.001176 0.47304 6.66667
444 2BH9 NAP 0.00224 0.44888 6.66667
445 1LTH NAD 0.00008611 0.43104 6.66667
446 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 0.02465 0.42174 6.66667
447 4JWX 1N4 0.009673 0.41954 6.66667
448 2A92 NAI 0.001031 0.41698 6.66667
449 1NYT NAP 0.004821 0.40712 6.66667
450 1SC3 MLI 0.003771 0.4631 6.81818
451 2W3L DRO 0.01859 0.43456 6.94444
452 3WMX NAD 0.0000005127 0.56322 7.05882
453 1T26 GBD 0.00005537 0.47271 7.05882
454 1T26 NAI 0.0007602 0.43393 7.05882
455 4RJK PYR 0.0312 0.4165 7.05882
456 1U5R ATP 0.003682 0.41481 7.05882
457 4RJK TPP 0.0003888 0.41182 7.05882
458 3SCH TB6 0.007964 0.43399 7.07071
459 2HVK TBA 0.0291 0.40737 7.07547
460 3G89 SAM 0.02367 0.40333 7.22892
461 3QV1 NAD 0.002149 0.41848 7.31707
462 3KJQ B94 0.005185 0.41728 7.31707
463 1JSH SIA GAL 0.002827 0.40089 7.38636
464 3EW2 BTN 0.001542 0.44891 7.40741
465 4TQG NDP 0.00000002479 0.57307 7.45098
466 2C5A NAD 0.000000171 0.45338 7.45098
467 1X8X TYR 0.003757 0.42752 7.45098
468 3GTD MLI 0.00959 0.42475 7.45098
469 3GD4 NAD 0.008787 0.41298 7.45098
470 2VHJ ADP 0.00242 0.41008 7.45098
471 1GR0 NAD 0.002282 0.4068 7.45098
472 1ZZ7 S0H 0.01158 0.41609 7.57576
473 1NXJ TLA 0.001076 0.43291 7.65027
474 1NXJ GLV 0.01856 0.40272 7.65027
475 3B9Z CO2 0.02071 0.41439 7.73196
476 4GKV NAD 0.0006117 0.42804 7.7381
477 1TH8 ADP 0.00772 0.41454 7.75862
478 1R37 NAD 0.00245 0.40566 7.78098
479 4W6Z ETF 0.003316 0.47403 7.84314
480 1H16 PYR 0.006951 0.44967 7.84314
481 4JRB PGT 0.001292 0.44156 7.84314
482 1LDN NAD 0.0001996 0.44025 7.84314
483 2CJH AKG 0.001242 0.43278 7.84314
484 2QV7 ADP 0.001848 0.42621 7.84314
485 4W6Z 8ID 0.002024 0.41115 7.84314
486 4F4S EFO 0.002311 0.44694 7.89474
487 1ULE GLA GAL NAG 0.002682 0.47058 8
488 1WRA PC 0.004025 0.45449 8.23529
489 3ABI NAD 0.0002834 0.44371 8.23529
490 4M51 BEZ 0.01556 0.43192 8.23529
491 5D63 FUC GLA GLA 0.01244 0.42485 8.23529
492 3O2K DST 0.008891 0.42116 8.23529
493 3O2K QRP 0.01407 0.40371 8.23529
494 1NU4 MLA 0.003235 0.49398 8.24742
495 1RL4 BL5 0.02582 0.4 8.51064
496 2Y6P CTP 0.005056 0.42217 8.54701
497 2FR1 NDP 0.0000000289 0.58439 8.62745
498 2NCD ADP 0.01296 0.41879 8.62745
499 3VTF UPG 0.002486 0.40967 8.62745
500 2BKA NDP 0.0000003406 0.53109 8.67769
501 1C1L GAL BGC 0.01382 0.42836 8.75912
502 1F5F DHT 0.003799 0.4104 8.78049
503 1UO4 PIH 0.04186 0.42232 8.82353
504 3UEC ALA ARG TPO LYS 0.005986 0.4461 8.90411
505 1GV0 NAD 0.000259 0.4324 9.01961
506 4P4T GDP 0.0009719 0.4281 9.01961
507 1I1Q TRP 0.008482 0.4173 9.01961
508 2OUA AES 0.01996 0.4284 9.04255
509 3ORF NAD 0.0000004816 0.5268 9.16335
510 1NF8 ISC 0.0009257 0.44739 9.17874
511 1NF8 BOG 0.02269 0.41779 9.17874
512 4O8A 2OP 0.00228 0.48258 9.41177
513 1HDG NAD 0.0008466 0.43787 9.41177
514 1GUZ NAD 0.0004344 0.42133 9.41177
515 1HDR NAD 0.00004317 0.40766 9.41177
516 3GM5 CIT 0.005016 0.44345 9.43396
517 1A5V Y3 0.001423 0.46242 9.49367
518 3L24 GOA 0.004909 0.46507 9.80392
519 1QO0 BMD 0.01865 0.41655 9.80392
520 1PEA ACM 0.03264 0.41549 9.80392
521 1LVL NAD 0.01247 0.40082 9.80392
522 2HV8 GTP 0.001519 0.40326 9.88372
523 1N9L FMN 0.0005432 0.43722 10.0917
524 1Y75 NAG 0.001153 0.4543 10.1695
525 1GPJ CIT 0.0004688 0.49179 10.1961
526 2Q1A 2KT 0.0007361 0.4826 10.1961
527 2PK3 A2R 0.000001294 0.4718 10.1961
528 2GN2 C5P 0.003023 0.41408 10.1961
529 1F3L SAH 0.001591 0.40927 10.1961
530 2O4C NAD 0.001757 0.40584 10.1961
531 2WPF FAD 0.02631 0.40025 10.1961
532 2WPF WPF 0.02692 0.40025 10.1961
533 4K28 NAD 0.0009419 0.43599 10.5882
534 3LM9 ADP 0.002865 0.42765 10.5882
535 2PR5 FMN 0.001888 0.41768 10.6061
536 4K30 NLG 0.0002891 0.48662 10.625
537 3A2Y TS5 0.001142 0.42976 10.6599
538 2PT9 S4M 0.00008763 0.40255 10.9034
539 3E6J DR2 0.03926 0.42048 10.917
540 1I0Z OXM 0.009536 0.44988 10.9804
541 1I0Z NAI 0.0002903 0.44332 10.9804
542 4DPL NAP 0.0004575 0.43581 10.9804
543 1LDM NAD 0.000577 0.43198 10.9804
544 1H9A NAP 0.0008577 0.42259 10.9804
545 1O6Z NAD 0.0002812 0.41305 10.9804
546 1O94 ADP 0.004329 0.41185 10.9804
547 3FIU POP 0.04622 0.40004 11.245
548 1V6A TRE 0.00125 0.4892 11.3725
549 2FYU FDN 0.001613 0.42015 11.5385
550 1RPN NDP 0.0000004881 0.5142 11.7647
551 3IAE D7K 0.0003908 0.40241 11.7647
552 4G4S LDZ 0.003499 0.41173 11.811
553 3QDT A2G GAL 0.0005563 0.50507 11.8881
554 3QDY A2G GAL 0.00103 0.49158 11.8881
555 3QDY CBS 0.006309 0.44498 11.8881
556 1DL7 NCH 0.02946 0.43863 11.9266
557 4Q3F TLA 0.01836 0.40291 11.9658
558 2JAR UMP 0.0006565 0.43425 12
559 3P7I P7I 0.001753 0.45222 12.1569
560 4E28 9MZ 0.005607 0.44117 12.1569
561 4E28 0MZ 0.008574 0.42697 12.1569
562 9LDT OXM 0.006367 0.46754 12.549
563 9LDB NAD 0.0001437 0.44531 12.549
564 9LDT NAD 0.0001497 0.4446 12.549
565 3K3K A8S 0.0008309 0.42644 12.9412
566 2QLX RM4 0.007406 0.44159 12.963
567 1OGD RIP 0.009267 0.42037 12.9771
568 1SAY PYR 0.00107 0.41902 13.3333
569 4BG1 OGA 0.002165 0.40821 13.7255
570 4BG1 IVL 0.002165 0.40821 13.7255
571 4L6C 0BT 0.0007746 0.41975 13.8614
572 1A5Z NAD 0.0001287 0.41681 14.1176
573 1A5Z OXM 0.04371 0.40897 14.1176
574 1H8P PC 0.003291 0.47421 14.6789
575 4Q9N NAI 0.00000004777 0.57189 15.2941
576 1NML CIT 0.006035 0.42858 15.2941
577 3H86 AP5 0.0008603 0.41116 16.1458
578 1T0S BML 0.001387 0.48505 16.2791
579 1P77 ATR 0.01314 0.43225 16.8627
580 1D1T NAD 0.001819 0.40791 16.8627
581 1GQ2 NAP 0.002367 0.4113 17.2549
582 2JC9 ADN 0.00817 0.42278 17.6471
583 4F8L GAL 0.007413 0.47328 17.931
584 1FK8 NAD 0.000000000001144 0.79846 18.0392
585 3RJ5 NAD 0.0000000007667 0.65575 18.1102
586 4J1Q NDP 0.0000003352 0.52766 18.8235
587 2OFE NAG 0.0221 0.41305 19.0141
588 1OAA OAA 0.000000000004248 0.75214 19.2157
589 1T10 F6P 0.003654 0.44382 19.2157
590 2FEQ 34P 0.005337 0.40492 19.4444
591 3S9K CIT 0.003381 0.50434 19.4915
592 2A2X NA9 0.00259 0.41272 20.5882
593 1H2M OGA 0.003022 0.45379 21.1538
594 1RYI GOA 0.007323 0.47558 22.3529
595 2PD4 DCN 0.00000005061 0.58151 23.5294
596 2PD4 NAD 0.00000005931 0.57894 23.5294
597 1N5D NDP 0.00000000002552 0.68946 24.3137
598 1HKU NAD 0.001369 0.41505 24.7059
599 1H2K OGA 0.004395 0.44615 26.8293
600 2FOI JPA 0.00683 0.41675 28.3333
601 1D7O NAD 0.0000005516 0.50597 28.6275
602 1GZ6 NAI 0.0000000006129 0.65231 29.0196
603 1ZBQ NAD 0.0000000001925 0.66443 29.4118
604 4R1S NAP 0.00000003059 0.55633 32.9412
605 2BD0 NAP 0.0000000000001757 0.77621 33.1967
606 1XSE NDP 0.000000000004583 0.74431 33.3333
607 4K26 SFF 0.00000000003314 0.70946 34.902
608 4K26 NDP 0.00000000000926 0.70581 34.902
609 1A27 NAP 0.0000000005091 0.63689 35.6863
610 3HB5 NAP 0.00000000008073 0.55647 35.6863
611 3HB5 E2B 0.001821 0.40074 35.6863
612 1W73 NAP 0.0000000001653 0.71888 36.4238
613 1W8D NAP 0.000000000133 0.6202 36.4238
614 4YAG NAI 0.0003713 0.44095 36.8627
615 3TN7 NJP 0.000000000002631 0.726 36.965
616 3CH6 311 0.00000000005434 0.73652 37.2549
617 1Z6Z NAP 0.000000000007522 0.70217 37.2549
618 1W6U NAP 0.000000000134 0.61906 37.4172
619 1SNY NAP 0.0000000001474 0.63458 38.0392
620 4FC7 NAP 0.0000000005868 0.66803 41.1765
621 2DKN NAI 0.0000000000001081 0.81062 41.5686
622 3O26 NDP 0.000000000001736 0.72365 41.5686
623 3OJF NDP 0.000000007273 0.61292 41.9608
624 3OJF IMJ 0.00000001871 0.60874 41.9608
625 5L53 NAP 0.000766 0.48178 41.9608
626 3GEG NAD 0.00000000003076 0.66484 42.1053
627 2WYV NAD 0.0000004983 0.53161 43.1373
628 3SJU NDP 0.00001754 0.52395 43.1373
629 4IXW IXW 0.002382 0.44086 43.1373
630 1E3W NAD 0.0000000000007746 0.76898 43.9216
631 1XG5 NAP 0.000000000001132 0.75446 43.9216
632 2WD7 NAP 0.000000000008997 0.69109 43.9216
633 1WMA AB3 0.000000000197 0.6881 43.9216
634 1QG6 NAD 0.00000001647 0.61423 43.9216
635 5CG1 NAD BBN 0.0000007662 0.4876 43.9216
636 1WMA NDP 0.001218 0.42058 43.9216
637 4ITU NAI 0.00000000001498 0.69402 44.2379
638 4ITU 1HS 0.00000000005337 0.59662 44.2379
639 3JQA NAP 0.00000000001187 0.73998 44.3137
640 3BMO NAP 0.000000000007705 0.73908 44.3137
641 3BMQ NAP 0.000000000005199 0.73757 44.3137
642 3JQF NAP 0.000000000005219 0.73751 44.3137
643 3JQG NAP 0.0000000000169 0.73396 44.3137
644 3JQB NAP 0.00000000001805 0.73283 44.3137
645 3JQ8 NAP 0.000000000005614 0.70611 44.3137
646 3BMN NAP 0.000000000007789 0.70122 44.3137
647 3JQ9 NAP 0.000000000009298 0.69848 44.3137
648 4CLO NAP 0.00003385 0.5235 44.3137
649 5JDC NAP 0.00003383 0.5196 44.3137
650 4CM4 NAP 0.00003759 0.51765 44.3137
651 5JCJ NAP 0.00003912 0.51691 44.3137
652 4CM8 NAP 0.00003935 0.5168 44.3137
653 4CMI NAP 0.00004072 0.51617 44.3137
654 4CME NAP 0.00004144 0.51585 44.3137
655 3JQ7 NAP 0.0001006 0.50305 44.3137
656 3D3W NAP 0.000000000004579 0.71661 44.6721
657 1NFQ NAI 0.0000000000008511 0.75101 44.7059
658 1MXH DHF 0.0000000004139 0.66585 44.7059
659 1MXH NAP 0.0000000005477 0.66127 44.7059
660 3OIG NAD 0.00000001122 0.57879 44.7059
661 2JAH NDP 0.000000000001263 0.73705 44.9393
662 3AFN NAP 0.0000000000002371 0.77442 45.098
663 4O0L NDP 0.00000000000581 0.72792 45.098
664 3ZV6 NAD 0.0000000001927 0.68458 45.098
665 3ZV6 4HB 0.0000000002169 0.68458 45.098
666 2JAP NDP 0.0000000000005709 0.76557 45.3441
667 2Q2V NAD 0.0000000000000705 0.79387 45.8824
668 1BDB NAD 0.000000000873 0.63118 46.2745
669 4O1M NAD 0.00000007332 0.56092 46.2745
670 3RKR NAP 0.00000003794 0.46254 46.2745
671 3KMZ EQO 0.0004417 0.41346 47.3684
672 5T2U NAP 0.000001405 0.56067 47.5806
673 2WSB NAD 0.000000000008116 0.73487 47.6378
674 3U4C NDP 0.0000000003139 0.63601 47.8431
675 1X1T NAD 0.0000000000002119 0.75982 48.2353
676 3OID NDP 0.000000000000309 0.77017 48.6275
677 1EDO NAP 0.000000000000001221 0.85506 48.7705
678 2EWM NAD 0.000000000001557 0.74928 48.996
679 4CQM NAP 0.0000000000007769 0.73636 49.4118
680 3V1U NAD 0.00000000000632 0.67073 49.4118
681 4NBU NAI 0.0000000000004391 0.76983 50
Pocket No.: 2; Query (leader) PDB : 3ICC; Ligand: NAP; 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: 3icc.bio1) has 30 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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