Receptor
PDB id Resolution Class Description Source Keywords
2HI8 1.64 Å EC: 7.-.-.- HUMAN FORMYLGLYCINE GENERATING ENZYME, C336S MUTANT, BROMIDE CRYSTALLIZATION HOMO SAPIENS HYDROLASE ACTIVATOR PROTEIN BINDING FORMYLGLYCIN GENERATIOTRANSLATIONAL MODIFICATION ENDOPLASMIC RETICULUM SULFATAS
Ref.: PROBING THE OXYGEN-BINDING SITE OF THE HUMAN FORMYLGLYCINE-GENERATING ENZYME USING HALIDE IONS. ACTA CRYSTALLOGR.,SECT.D V. 63 621 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BR X:1001;
X:1002;
X:1003;
X:1004;
X:1005;
X:1006;
X:1007;
X:1008;
X:1009;
X:1010;
X:1011;
X:1012;
X:1013;
X:1014;
X:1015;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
79.904 Br [Br-]
CA X:1016;
X:1017;
Part of Protein;
Part of Protein;
none;
none;
submit data
40.078 Ca [Ca+2...
CL X:1018;
Invalid;
none;
submit data
35.453 Cl [Cl-]
CYS THR PRO SER ARG P:1;
Valid;
none;
submit data
563.657 n/a SCC([...
NAG NAG X:1;
Part of Protein;
none;
submit data
408.404 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2HI8 1.64 Å EC: 7.-.-.- HUMAN FORMYLGLYCINE GENERATING ENZYME, C336S MUTANT, BROMIDE CRYSTALLIZATION HOMO SAPIENS HYDROLASE ACTIVATOR PROTEIN BINDING FORMYLGLYCIN GENERATIOTRANSLATIONAL MODIFICATION ENDOPLASMIC RETICULUM SULFATAS
Ref.: PROBING THE OXYGEN-BINDING SITE OF THE HUMAN FORMYLGLYCINE-GENERATING ENZYME USING HALIDE IONS. ACTA CRYSTALLOGR.,SECT.D V. 63 621 2007
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 250 families.
1 2HI8 - CYS THR PRO SER ARG n/a n/a
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 217 families.
1 2HI8 - CYS THR PRO SER ARG n/a n/a
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 181 families.
1 2HI8 - CYS THR PRO SER ARG n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: CYS THR PRO SER ARG; Similar ligands found: 111
No: Ligand ECFP6 Tc MDL keys Tc
1 CYS THR PRO SER ARG 1 1
2 ALA ASN SER ARG VAL PRO THR SER ILE ILE 0.544715 0.924242
3 SER LEU SER ARG THR PRO ALA ASP GLY ARG 0.541985 0.938462
4 SER ALA PRO ASP THR ARG PRO ALA 0.536585 0.910448
5 THR LYS PRO ARG 0.534653 0.825397
6 GLU PRO GLY GLY SER ARG 0.530435 0.90625
7 ASN ARG PRO ILE LEU SER LEU 0.528455 0.882353
8 SER GLU CYS THR THR PRO CYS 0.526316 0.859375
9 SER ARG ASP HIS SER ARG THR PRO MET 0.524823 0.849315
10 GLU ARG THR ILE PRO ILE THR ARG GLU 0.516129 0.895522
11 ARG THR PRO SEP LEU PRO THR 0.511811 0.808219
12 GLN ARG SER THR SEP THR PRO ASN VAL HIS 0.507463 0.833333
13 SER PRO LYS ARG ILE ALA 0.504132 0.878788
14 ALA PRO ASP THR ARG PRO ALA PRO 0.5 0.895522
15 ARG ARG ARG GLU ARG SER PRO THR ARG 0.5 0.953125
16 DPN PRO DAR DTH NH2 0.5 0.890625
17 ALA PRO ASP THR ARG PRO 0.5 0.895522
18 ARG ILE PRO SER TYR ARG TYR ARG TYR 0.5 0.821918
19 LYS PRO VAL LEU ARG THR ALA 0.492063 0.893939
20 LYS LEU THR PRO LEU CYS VAL THR LEU 0.491935 0.818182
21 THR PRO ARG ARG SER MLZ SER ALA 0.491803 0.869565
22 DPN PRO ARG 0.490741 0.8125
23 ALA ASN SER ARG ALA PRO THR SER ILE ILE 0.488722 0.897059
24 ALA MET ALA PRO ARG THR LEU LEU LEU 0.488372 0.857143
25 GLU LYS PRO SER SER SER 0.481818 0.8125
26 ARG VAL ALA SER PRO THR SER GLY VAL 0.48062 0.938462
27 ACE GLN GLU ARG GLU VAL PRO CYS 0.480315 0.820895
28 5JP PRO LYS ARG ILE ALA 0.47619 0.852941
29 ARG PRO LYS ARG ILE ALA 0.471545 0.833333
30 ACE ARG THR PRO SEP LEU PRO THR PIP 0.470149 0.766234
31 ALA ASN SER ARG TYR PRO THR SER ILE ILE 0.468531 0.847222
32 GLY GLU ARG THR ILE PRO ILE THR ARG GLU 0.465649 0.895522
33 GLY ARG PRO ARG THR THR SER PHE ALA GLU 0.465278 0.910448
34 ALA ARG MLZ SER ALA PRO ALA THR 0.464567 0.855072
35 DPN PRO DAR CYS NH2 0.461538 0.8125
36 ARG SER ARG 0.457447 0.741935
37 ASN LEU VAL PRO SER VAL ALA THR VAL 0.456693 0.820895
38 ARG ARG LEU PRO ILE PHE SER ARG LEU 0.453901 0.869565
39 SER HIS PRO ARG PRO ILE ARG VAL 0.453237 0.84507
40 ALA ASN SER ARG TRP PRO THR THR ARG LEU 0.452555 0.833333
41 ALA ASN SER ARG ALY PRO THR SER ILE ILE 0.451389 0.871429
42 DPN PRO DAR ILE NH2 0.45 0.776119
43 LEU ASP PRO ARG 0.448276 0.818182
44 PHE ASN ARG PRO VAL 0.448 0.823529
45 THR PRO THR ARG ASP VAL ALA THR SER PRO 0.445312 0.938462
46 ARG VAL ALA SEP PRO THR SER GLY VAL 0.442857 0.859155
47 PRO THR PRO SER ALA PRO VAL PRO LEU 0.442623 0.794118
48 ARG THR PRO SEP LEU PRO THR 49F 0.442177 0.75641
49 ARG PRO GLN VAL PRO LEU ARG PRO MET 0.442029 0.788732
50 ALA ASN SER ARG LEU PRO THR SER ILE ILE 0.440678 0.818182
51 LYS ARG ARG ARG HIS PRO SER GLY 0.440298 0.852941
52 GLY LEU LEU GLY SER PRO VAL ARG ALA 0.439394 0.878788
53 GLN ALA SER TPO PRO ARG NIT 0.439189 0.731707
54 SER THR CYS PRO ALA ALA 0.436364 0.857143
55 ALA ASN SER ARG PHE PRO THR SER ILE ILE 0.435374 0.884058
56 VAL MET ALA PRO ARG ALA LEU LEU LEU 0.435115 0.785714
57 GLN VAL PRO LEU ARG PRO MET THR TYR LYS 0.433962 0.813333
58 TYR PRO LYS ARG ILE ALA 0.433824 0.788732
59 LEU PRO PHE ASP ARG THR THR ILE MET 0.433333 0.835616
60 ACE ARG THR PRO SEP LEU PRO THR 60H 0.432432 0.75641
61 SER SER GLY LYS VAL PRO LEU SER 0.432 0.791045
62 ALA ALA ARG KCR SER ALA PRO ALA 0.430657 0.893939
63 DMG PRO ARG ARG ARG SER ARG LYS PRO 0.429752 0.855072
64 SER PRO HIS ASN PRO ILE SER ASP VAL ASP 0.429752 0.782609
65 ASN ARG PRO VAL TYR ILE PRO ARG PRO PRO 0.428571 0.777778
66 LEU GLN ARG VAL LEU SEP ALA PRO PHE 0.426573 0.783784
67 ASN PRO ARG ALA MET GLN ALA LEU LEU 0.426471 0.788732
68 ASP LEU THR ARG PRO 0.42623 0.909091
69 SER SER GLY LYS VAL PRO LEU 0.42623 0.776119
70 VAL MET ALA PRO ARG THR LEU PHE LEU 0.425676 0.833333
71 ALA ASN SER ARG TRP PRO THR SER ALY ILE 0.424837 0.824324
72 VAL PRO LEU ARG PRO MET THR TYR 0.424658 0.824324
73 LYS ALA PRO ARG ALY GLN LEU ALA THR LYS 0.423611 0.855072
74 ARG GLN ALA SEP ILE GLU LEU PRO SER MET 0.42236 0.792208
75 GLN PRO PRO VAL PRO PRO GLN ARG PRO MET 0.421429 0.788732
76 SER VAL PRO ILE 0.420561 0.757576
77 ARG PRO ARG PRO ASP ASP LEU GLU ILE 0.42029 0.811594
78 ALA THR PRO PHE GLN GLU 0.419643 0.753846
79 ARG SER ALA SEP GLU PRO SER LEU 0.41958 0.821918
80 LEU PRO PHE GLU ARG ALA THR VAL MET 0.419355 0.833333
81 SER SER CYS PRO LEU SER LYS 0.418033 0.80303
82 SER LEU ILE PRO TPO PRO ASP LYS 0.417266 0.733333
83 ASP VAL GLN THR GLY ARG ARG PRO TYR GLU 0.417219 0.84507
84 VAL VAL ARG PRO GLY SER LEU ASP LEU PRO 0.414966 0.882353
85 ARG VAL SER PRO SER THR SER TYR THR PRO 0.414062 0.768116
86 ASP ARG VAL GLU LEU ASN ALA PRO ARG GLN 0.413043 0.811594
87 GLY SER ASP PRO PHE LYS 0.412698 0.787879
88 ARG SEP PRO VAL PHE SER 0.412587 0.805556
89 SER SER TYR ARG ARG PRO VAL GLY ILE 0.412162 0.821918
90 ARG ILE ILE PRO ARG HIS LEU GLN LEU 0.410596 0.763889
91 PHE CYS HIS PRO GLN ASN THR NH2 0.410448 0.808824
92 ASN TYR THR PRO GLY PRO GLY THR ARG PHE 0.410256 0.821918
93 LEU SER SER PRO VAL THR LYS SER PHE 0.410072 0.794118
94 ARG ARG ALA SEP ALA PRO LEU PRO 0.410072 0.77027
95 GLY THR SER SER PRO SER ALA ASP 0.409836 0.84375
96 HIS HIS ALA SER PRO ARG LYS 0.409722 0.838235
97 ASP SER THR THR PRO ALA PRO THR 0.409091 0.742424
98 ARG PRO LYS PRO LEU VAL ASP PRO 0.408 0.791045
99 LYS PRO LYS 0.407767 0.68254
100 LYS ARG ARG ARG HIS PRO SER 0.407407 0.835821
101 GLU PTR LEU GLY LEU ASP VAL PRO VAL 0.40708 0.712121
102 SER PRO ARG LEU PRO LEU LEU GLU SER 0.40625 0.776119
103 PRO SER ILE ASP ARG SER THR LYS PRO 0.40411 0.897059
104 TYR SEP PRO THR SEP PRO SER 0.403101 0.743243
105 ASN LEU VAL PRO THR VAL ALA THR VAL 0.403101 0.791045
106 LEU PRO PHE GLU ARG ALA THR ILE MET 0.402516 0.821918
107 PRO PRO PRO VAL PRO PRO ARG ARG ARG ARG 0.401575 0.80303
108 PRO PRO LYS ARG ILE ALA 0.401515 0.80597
109 ASN TYR THR PRO GLY PRO GLY ILE ARG PHE 0.4 0.786667
110 ASN LEU VAL PRO VAL VAL ALA THR VAL 0.4 0.791045
111 GLY PRO ARG PRO 0.4 0.784615
Similar Binding Sites (Proteins are less than 50% similar to leader)
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