Chlorine in PDB 1puu: Mistletoe Lectin I in Complex with Lactose

The structure of Mistletoe Lectin I in Complex with Lactose, PDB code: 1puu was solved by R.Krauspenhaar, W.Voelter, S.Stoeva, A.Mikhailov, N.Konareva, C.Betzel, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	10.00 / 2.30
Space group	P 65 2 2
Cell size a, b, c (Å), α, β, γ (°)	106.278, 106.278, 312.329, 90.00, 90.00, 120.00
R / Rfree (%)	20.7 / 23.2

The binding sites of Chlorine atom in the Mistletoe Lectin I in Complex with Lactose (pdb code 1puu). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Mistletoe Lectin I in Complex with Lactose, PDB code: 1puu:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Mistletoe Lectin I in Complex with Lactose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Mistletoe Lectin I in Complex with Lactose within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1024 b:40.5 occ:0.50 NH2 A:ARG150 3.6 59.9 1.0 O A:HOH2086 4.0 45.4 1.0 CA A:GLY123 4.1 34.2 1.0 NH1 A:ARG150 4.4 58.9 1.0 CZ A:ARG150 4.4 57.8 1.0 ND1 A:HIS124 4.5 44.4 1.0 CE1 A:HIS124 4.8 44.6 1.0 N A:HIS124 5.0 33.8 1.0

Chlorine binding site 2 out of 3 in the Mistletoe Lectin I in Complex with Lactose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Mistletoe Lectin I in Complex with Lactose within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1027 b:85.3 occ:1.00 O A:HOH2139 3.3 64.0 1.0 NH2 A:ARG154 4.1 47.7 1.0 O A:HOH2140 4.5 63.3 1.0 CZ A:ARG154 4.5 47.8 1.0 NE A:ARG154 4.8 46.1 1.0

Chlorine binding site 3 out of 3 in the Mistletoe Lectin I in Complex with Lactose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Mistletoe Lectin I in Complex with Lactose within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1042 b:59.9 occ:1.00 OD1 A:ASN216 2.7 44.2 1.0 NE2 A:GLN205 3.6 34.6 1.0 ND1 A:HIS208 3.8 35.6 1.0 CG A:ASN216 3.9 41.4 1.0 CB A:ASN215 4.6 37.7 1.0 CD A:GLN205 4.6 34.1 1.0 CB A:HIS208 4.6 32.5 1.0 CG A:HIS208 4.7 35.6 1.0 CB A:ASN216 4.7 35.8 1.0 CE1 A:HIS208 4.7 36.9 1.0 OE1 A:GLN205 4.8 33.8 1.0 ND2 A:ASN216 4.9 41.6 1.0

R.Mikeska, R.Wacker, R.Arni, T.P.Singh, A.Mikhailov, A.Gabdoulkhakov, W.Voelter, C.Betzel. Mistletoe Lectin I in Complex with Galactose and Lactose Reveals Distinct Sugar-Binding Properties Acta Crystallogr.,Sect.F V. 61 17 2005.
ISSN: ESSN 1744-3091
PubMed: 16508080
DOI: 10.1107/S1744309104031501