Please note that you are looking at an abridged version of the output (all checks that gave normal results have been removed from this report). You can have a look at the Full report instead.

The CRYST1 cell dimensions

A = 94.170 B = 94.560 C = 95.890 Alpha= 90.000 Beta= 90.000 Gamma= 90.000

Dimensions of a reduced cell

A = 94.170 B = 94.560 C = 95.890 Alpha= 90.000 Beta= 90.000 Gamma= 90.000

Dimensions of the conventional cell

A = 94.560 B = 94.170 C = 95.890 Alpha= 90.000 Beta= 90.000 Gamma= 90.000

Transformation to conventional cell

| 0.000000 -1.000000 0.000000| | 1.000000 0.000000 0.000000| | 0.000000 0.000000 1.000000|

Crystal class of the cell: ORTHORHOMBIC

Crystal class of the conventional cell: TETRAGONAL

Space group name: P 21 21 21

Bravais type of conventional cell is: P

Chain identifiers of the two chains: A and B

All-atom RMS fit for the two chains : 1.005

CA-only RMS fit for the two chains : 0.731

Chain identifiers of the two chains: A and B

Chain identifiers of the two chains: A and C

All-atom RMS fit for the two chains : 0.961

CA-only RMS fit for the two chains : 0.578

Chain identifiers of the two chains: A and C

Chain identifiers of the two chains: A and D

All-atom RMS fit for the two chains : 0.850

CA-only RMS fit for the two chains : 0.543

Chain identifiers of the two chains: A and D

Chain identifiers of the two chains: A and E

All-atom RMS fit for the two chains : 1.020

CA-only RMS fit for the two chains : 0.750

Chain identifiers of the two chains: A and E

Chain identifiers of the two chains: A and F

All-atom RMS fit for the two chains : 1.096

CA-only RMS fit for the two chains : 0.764

Chain identifiers of the two chains: A and F

In X-ray the coordinates must be located in density. Mobility or disorder sometimes cause this density to be so poor that the positions of the atoms cannot be determined. Crystallographers tend to leave out the atoms in such cases. This is not an error, albeit that we would prefer them to give it their best shot and provide coordinates with an occupancy of zero in cases where only a few atoms are involved. Anyway, several checks depend on the presence of the backbone atoms, so if you find errors in, or directly adjacent to, residues with missing backbone atoms, then please check by hand what is going on.

149 LEU ( 157-) A - 298 LEU ( 157-) B - 447 LEU ( 157-) C - 596 LEU ( 157-) D - 745 LEU ( 157-) E - 894 LEU ( 157-) F -

SCALE matrix obtained from PDB file

Proposed new scale matrix

With corresponding cell

The CRYST1 cell dimensions