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Receptor
PDB id Resolution Class Description Source Keywords
1YNS 1.7 Å EC: 3.-.-.- CRYSTAL STRUCTURE OF HUMAN ENOLASE-PHOSPHATASE E1 AND ITS CO A SUBSTRATE ANALOG HOMO SAPIENS HYDROLASE FOLD HYDROLASE
Ref.: CRYSTAL STRUCTURE OF HUMAN E1 ENZYME AND ITS COMPLE SUBSTRATE ANALOG REVEALS THE MECHANISM OF ITS PHOSPHATASE/ENOLASE J.MOL.BIOL. V. 348 917 2005
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
HPO A:1261;
Valid;
none;
submit data
194.165 C7 H15 O4 P CCCCC...
MG A:1258;
A:1259;
A:1260;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1YNS 1.7 Å EC: 3.-.-.- CRYSTAL STRUCTURE OF HUMAN ENOLASE-PHOSPHATASE E1 AND ITS CO A SUBSTRATE ANALOG HOMO SAPIENS HYDROLASE FOLD HYDROLASE
Ref.: CRYSTAL STRUCTURE OF HUMAN E1 ENZYME AND ITS COMPLE SUBSTRATE ANALOG REVEALS THE MECHANISM OF ITS PHOSPHATASE/ENOLASE J.MOL.BIOL. V. 348 917 2005
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 253 families.
1 1YNS - HPO C7 H15 O4 P CCCCCC(=O)....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 209 families.
1 1YNS - HPO C7 H15 O4 P CCCCCC(=O)....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 173 families.
1 1YNS - HPO C7 H15 O4 P CCCCCC(=O)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: HPO; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 HPO 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1YNS; Ligand: HPO; Similar sites found with APoc: 108
This union binding pocket(no: 1) in the query (biounit: 1yns.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
1 1L5Y BEF None
2 1D1G NDP None
3 3KO0 TFP None
4 2JAR UMP 1
5 4L6C 0BT 1.48515
6 2Y7G AAE 1.53257
7 1KO8 6PG 1.71429
8 2QZS 250 1.91571
9 2QZS ADP 1.91571
10 2QZS GLC 1.91571
11 1S20 TLA 1.91571
12 4HA9 NDP 2.00803
13 4ZBA GDS 2.24215
14 1XKQ NDP 2.29885
15 3D3W NAP 2.45902
16 1PR9 NAP 2.45902
17 1KRR ACO 2.46305
18 1DNP FAD 2.68199
19 4PLT NAI 2.68199
20 5W3K NDP 2.68199
21 5W3K 9TY 2.68199
22 5KOD AMP 2.68199
23 2ZGY GDP 2.68199
24 3C1X CKK 2.68199
25 4IF4 BEF 2.88462
26 4D9M 0JO 3.06513
27 6CUZ FEV 3.06513
28 1VL8 NAP 3.06513
29 3PFG TLO 3.06513
30 3PFG SAM 3.06513
31 5HSA FAS 3.06513
32 2BL9 CP6 3.06513
33 2FKA BEF 3.10078
34 3FGZ BEF 3.125
35 3EWP APR 3.38983
36 4ZEV M6P 3.44828
37 1XG5 NAP 3.44828
38 5XJ8 NKO 3.48259
39 3EWK FAD 3.52423
40 2CXG GLC G6D ACI GLC 3.83142
41 4NBU NAI 4
42 1RQL VSO 4.21456
43 5AE2 FYC 4.21456
44 1JQ3 AAT 4.21456
45 5AK0 8V1 4.21456
46 4MIG G3F 4.21456
47 5W8Q BU4 4.21456
48 5MY8 RXZ 4.21456
49 5AXH GLC GLC GLC GLC 4.21456
50 3OCZ SRA 4.58015
51 1QNF HDF 4.5977
52 1QNF FAD 4.5977
53 4FE3 U5P 4.5977
54 5YJI SAH 4.5977
55 4ELG 52J 4.81928
56 4AP3 NAP 4.98084
57 4AP3 FAD 4.98084
58 1EIX BMQ 5.36398
59 3A1C ACP 5.36398
60 5DX9 T6P 5.74713
61 1E2K TMC 5.74713
62 4DV8 0LX 5.74713
63 6FRN FMN 5.74713
64 5WKC FAD 5.74713
65 5H4S RAM 5.74713
66 1KI6 AHU 5.74713
67 5A89 ADP 5.76923
68 5A89 FMN 5.76923
69 4R6W SAH 5.81395
70 1Z4O GL1 5.88235
71 2H7C COA 6.13027
72 2VVT I24 6.13027
73 4JD3 COA 6.13027
74 4UME KDO 6.21762
75 1FK5 OLA 6.45161
76 1BOB ACO 6.51341
77 6HH6 A3R 6.51341
78 5YJF SAH 6.51341
79 5YJF 8WO 6.51341
80 4XDZ NDP 6.51341
81 2P69 PLP 7.27969
82 4DJA FAD 7.66284
83 4DJA DLZ 7.66284
84 1HE1 GDP 8.52273
85 2RBK VN4 8.81226
86 1T0I FMN 9.42408
87 5NUF NAD 10.3448
88 1DBT U5P 10.4603
89 3VC3 C6P 10.7558
90 3F6R FMN 11.4865
91 3ZLR X0B 12.6582
92 3DJL FAD 13.0268
93 1VCE SAH 13.0268
94 1WNG SAH 13.41
95 3MJY IJZ 13.7931
96 3MJY FMN 13.7931
97 5YU3 NAD 15.3257
98 5YU3 PRO 15.3257
99 1L7N AF3 15.6398
100 1L7N ALF 15.6398
101 1YKI FMN 16.129
102 2YN4 39J 17.3729
103 5CXI 5TW 17.734
104 4YDQ ANP 22.6054
105 4YDQ HFG 22.6054
106 1QH9 LAC 27.5862
107 1FM9 570 28
108 3RNM FAD 32.7586
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