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PDBsum entry 4qw4
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Hydrolase/hydrolase inhibitor PDB id
4qw4
Contents
Protein chains
250 a.a.
244 a.a.
240 a.a.
235 a.a.
231 a.a.
243 a.a.
241 a.a.
222 a.a.
204 a.a.
195 a.a.
212 a.a.
222 a.a.
233 a.a.
196 a.a.
Ligands
3BV ×6
MES ×4
Metals
_CL ×4
_MG ×7
Waters ×332
procheck   Generate full PROCHECK analyses

PROCHECK summary for 4qw4

Ramachandran plot

PROCHECK statistics

1. Ramachandran Plot statistics


                                         No. of
                                        residues     %-tage
                                         ------      ------
Most favoured regions      [A,B,L]         5152       92.4%          
Additional allowed regions [a,b,l,p]        392        7.0%          
Generously allowed regions [~a,~b,~l,~p]     14        0.3%          
Disallowed regions         [XX]              16        0.3%*  
                                           ----      ------
Non-glycine and non-proline residues       5574      100.0%

End-residues (excl. Gly and Pro)             52

Glycine residues                            516
Proline residues                            194
                                           ----
Total number of residues                   6336

Based on an analysis of 118 structures of resolution of at least 2.0 Angstroms and R-factor no greater than 20.0 a good quality model would be expected to have over 90% in the most favoured regions [A,B,L].

2. G-Factors

                                                Average
Parameter                            Score       Score
---------                            -----       -----
Dihedral angles:-
     Phi-psi distribution            -0.07      
     Chi1-chi2 distribution          -0.03      
     Chi1 only                        0.09      
     Chi3 & chi4                      0.45      
     Omega                           -0.28      
                                                  -0.06      
                                                  =====
Main-chain covalent forces:-
     Main-chain bond lengths          0.66      
     Main-chain bond angles           0.59      
                                                   0.62      
                                                  =====

     OVERALL AVERAGE                               0.20      
                                                  =====

G-factors provide a measure of how unusual, or out-of-the-ordinary, a property is. 

Values below -0.5*  - unusual
Values below -1.0** - highly unusual
Important note: The main-chain bond-lengths and bond angles are compared with the Engh & Huber (1991) ideal values derived from small-molecule data. Therefore, structures refined using different restraints may show apparently large deviations from normality.

 

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