org.rcsb.cif.schema.mm.PdbxValidateChiral Maven / Gradle / Ivy
package org.rcsb.cif.schema.mm;
import org.rcsb.cif.model.*;
import org.rcsb.cif.schema.*;
import javax.annotation.Generated;
/**
* Data items in the PDBX_VALIDATE_CHIRAL category list the
* residues that contain unexpected configuration of chiral
* centers.
* IMPROPER HA N C CB chirality CA
* IMPROPER HB1 HB2 CA CG stereo CB
* as this number approaches (+) or (-) 180.0, then the
* error in predicting the true chirality of the center increases.
* Improper dihedrals are a measure of the chirality/planarity of the
* structure at a specific atom. Values around -35 or +35 are expected
* for chiral atoms, and values around 0 for planar atoms.
* HERE improper C---N----CA---CB done
* expected answer is around -120 mean -122.52
* D-amino acid is +120.0
*/
@Generated("org.rcsb.cif.schema.generator.SchemaGenerator")
public class PdbxValidateChiral extends DelegatingCategory {
public PdbxValidateChiral(Category delegate) {
super(delegate);
}
@Override
protected Column createDelegate(String columnName, Column column) {
switch (columnName) {
case "id":
return getId();
case "PDB_model_num":
return getPDBModelNum();
case "auth_asym_id":
return getAuthAsymId();
case "auth_atom_id":
return getAuthAtomId();
case "label_alt_id":
return getLabelAltId();
case "auth_comp_id":
return getAuthCompId();
case "auth_seq_id":
return getAuthSeqId();
case "PDB_ins_code":
return getPDBInsCode();
case "omega":
return getOmega();
case "details":
return getDetails();
default:
return new DelegatingColumn(column);
}
}
/**
* The value of _pdbx_validate_chiral.id must
* uniquely identify each item in the PDBX_VALIDATE_CHIRAL list.
* This is an integer serial number.
* @return IntColumn
*/
public IntColumn getId() {
return delegate.getColumn("id", DelegatingIntColumn::new);
}
/**
* The model number for the given residue
*
* This data item is a pointer to _atom_site.pdbx_PDB_model_num in the
* ATOM_SITE category.
* @return IntColumn
*/
public IntColumn getPDBModelNum() {
return delegate.getColumn("PDB_model_num", DelegatingIntColumn::new);
}
/**
* Part of the identifier of the residue
*
* This data item is a pointer to _atom_site.auth_asym_id in the
* ATOM_SITE category.
* @return StrColumn
*/
public StrColumn getAuthAsymId() {
return delegate.getColumn("auth_asym_id", DelegatingStrColumn::new);
}
/**
* Part of the identifier of the residue
*
* This data item is a pointer to _atom_site.auth_atom_id in the
* ATOM_SITE category.
* @return StrColumn
*/
public StrColumn getAuthAtomId() {
return delegate.getColumn("auth_atom_id", DelegatingStrColumn::new);
}
/**
* Part of the identifier of the residue
*
* This data item is a pointer to _atom_site.label_alt_id in the
* ATOM_SITE category.
* @return StrColumn
*/
public StrColumn getLabelAltId() {
return delegate.getColumn("label_alt_id", DelegatingStrColumn::new);
}
/**
* Part of the identifier of the residue
*
* This data item is a pointer to _atom_site.auth_comp_id in the
* ATOM_SITE category.
* @return StrColumn
*/
public StrColumn getAuthCompId() {
return delegate.getColumn("auth_comp_id", DelegatingStrColumn::new);
}
/**
* Part of the identifier of the residue
*
* This data item is a pointer to _atom_site.auth_seq_id in the
* ATOM_SITE category.
* @return StrColumn
*/
public StrColumn getAuthSeqId() {
return delegate.getColumn("auth_seq_id", DelegatingStrColumn::new);
}
/**
* Optional identifier of the residue
*
* This data item is a pointer to _atom_site.pdbx_PDB_ins_code in the
* ATOM_SITE category.
* @return StrColumn
*/
public StrColumn getPDBInsCode() {
return delegate.getColumn("PDB_ins_code", DelegatingStrColumn::new);
}
/**
* The value of the OMEGA angle for the peptide linkage between
* the two defined residues
* @return FloatColumn
*/
public FloatColumn getOmega() {
return delegate.getColumn("omega", DelegatingFloatColumn::new);
}
/**
* A description of the outlier angle e.g. ALPHA-CARBON
* @return StrColumn
*/
public StrColumn getDetails() {
return delegate.getColumn("details", DelegatingStrColumn::new);
}
}