Fluorine in PDB 1znt: 18 uc(Nmr) Structures of ACAMP2-Like Peptide with Non Natural Fluoroaromatic Residue (ACAMP2F18PFF/Y20PFF) Complex with N,N,N- Triacetylchitotriose

The binding sites of Fluorine atom in the 18 uc(Nmr) Structures of ACAMP2-Like Peptide with Non Natural Fluoroaromatic Residue (ACAMP2F18PFF/Y20PFF) Complex with N,N,N- Triacetylchitotriose (pdb code 1znt). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 2 binding sites of Fluorine where determined in the 18 uc(Nmr) Structures of ACAMP2-Like Peptide with Non Natural Fluoroaromatic Residue (ACAMP2F18PFF/Y20PFF) Complex with N,N,N- Triacetylchitotriose, PDB code: 1znt:
Jump to Fluorine binding site number: 1; 2;

Fluorine binding site 1 out of 2 in the 18 uc(Nmr) Structures of ACAMP2-Like Peptide with Non Natural Fluoroaromatic Residue (ACAMP2F18PFF/Y20PFF) Complex with N,N,N- Triacetylchitotriose


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of 18 uc(Nmr) Structures of ACAMP2-Like Peptide with Non Natural Fluoroaromatic Residue (ACAMP2F18PFF/Y20PFF) Complex with N,N,N- Triacetylchitotriose within 5.0Å range: probe atom residue distance (Å) B Occ A:F18 b:0.0 occ:1.00 F A:PFF18 0.0 0.0 1.0 CZ A:PFF18 1.4 0.0 1.0 HO6 A:NAG32 2.3 0.0 1.0 CE2 A:PFF18 2.4 0.0 1.0 CE1 A:PFF18 2.4 0.0 1.0 HE2 A:PFF18 2.6 0.0 1.0 HE1 A:PFF18 2.6 0.0 1.0 H82 A:NAG33 2.8 0.0 1.0 O6 A:NAG32 3.0 0.0 1.0 H1 A:NAG33 3.5 0.0 1.0 C7 A:NAG33 3.5 0.0 1.0 C8 A:NAG33 3.5 0.0 1.0 H61 A:NAG32 3.6 0.0 1.0 CD2 A:PFF18 3.7 0.0 1.0 CD1 A:PFF18 3.7 0.0 1.0 N2 A:NAG33 3.7 0.0 1.0 HN2 A:NAG33 3.7 0.0 1.0 C6 A:NAG32 3.9 0.0 1.0 H81 A:NAG33 3.9 0.0 1.0 O7 A:NAG33 4.0 0.0 1.0 H3 A:NAG33 4.1 0.0 1.0 CG A:PFF18 4.2 0.0 1.0 H62 A:NAG32 4.3 0.0 1.0 C1 A:NAG33 4.3 0.0 1.0 H83 A:NAG33 4.4 0.0 1.0 C2 A:NAG33 4.5 0.0 1.0 HD1 A:PFF18 4.5 0.0 1.0 HD2 A:PFF18 4.5 0.0 1.0 H4 A:NAG32 4.8 0.0 1.0 O4 A:NAG32 4.8 0.0 1.0 C3 A:NAG33 4.8 0.0 1.0 H5 A:NAG33 5.0 0.0 1.0

Fluorine binding site 2 out of 2 in the 18 uc(Nmr) Structures of ACAMP2-Like Peptide with Non Natural Fluoroaromatic Residue (ACAMP2F18PFF/Y20PFF) Complex with N,N,N- Triacetylchitotriose


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of 18 uc(Nmr) Structures of ACAMP2-Like Peptide with Non Natural Fluoroaromatic Residue (ACAMP2F18PFF/Y20PFF) Complex with N,N,N- Triacetylchitotriose within 5.0Å range: probe atom residue distance (Å) B Occ A:F20 b:0.0 occ:1.00 F A:PFF20 0.0 0.0 1.0 CZ A:PFF20 1.4 0.0 1.0 CE2 A:PFF20 2.4 0.0 1.0 CE1 A:PFF20 2.4 0.0 1.0 HE1 A:PFF20 2.6 0.0 1.0 HE2 A:PFF20 2.6 0.0 1.0 H62 A:NAG34 3.0 0.0 1.0 CD2 A:PFF20 3.7 0.0 1.0 CD1 A:PFF20 3.7 0.0 1.0 HB3 A:GLU3 3.7 0.0 1.0 HO6 A:NAG34 3.9 0.0 1.0 C6 A:NAG34 3.9 0.0 1.0 H4 A:NAG34 4.0 0.0 1.0 O6 A:NAG34 4.0 0.0 1.0 CG A:PFF20 4.2 0.0 1.0 H3 A:VAL1 4.5 0.0 1.0 HO4 A:NAG34 4.5 0.0 1.0 HD2 A:PFF20 4.5 0.0 1.0 HD1 A:PFF20 4.6 0.0 1.0 OE1 A:GLU3 4.6 0.0 1.0 H61 A:NAG34 4.6 0.0 1.0 CB A:GLU3 4.7 0.0 1.0 C4 A:NAG34 4.8 0.0 1.0 H2 A:VAL1 4.9 0.0 1.0 C5 A:NAG34 4.9 0.0 1.0 HB2 A:GLU3 4.9 0.0 1.0 O4 A:NAG34 5.0 0.0 1.0

M.I.Chavez, C.Andreu, P.Vidal, N.Aboitiz, F.Freire, P.Groves, J.L.Asensio, G.Asensio, M.Muraki, F.J.Canada, J.Jimenez-Barbero. On the Importance of Carbohydrate-Aromatic Interactions For the Molecular Recognition of Oligosaccharides By Proteins: uc(Nmr) Studies of the Structure and Binding Affinity of ACAMP2-Like Peptides with Non-Natural Naphthyl and Fluoroaromatic Residues Chemistry V. 11 7060 2005.
ISSN: ISSN 0947-6539
PubMed: 16220560
DOI: 10.1002/CHEM.200500367