Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3a24109cefd0db1b30f46c81b9c39402",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 98.33,
"b": 98.33,
"c": 268.43,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.320,2.300],
"number_observations": 1638294,
"number_observations_unique": 59592,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(meas)",
"value": 0.114
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 25.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 27.500
}
]
},
"refln_shells": [
{
"resolution_limits": [2.360,2.300],
"number_observations": 119765,
"number_observations_unique": 4335,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.742
},
{
"type": "R(meas)",
"value": 0.756
},
{
"type": "R(pim)",
"value": 0.142
},
{
"type": "I/SigI",
"value": 5.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 27.600
}
]
},
{
"resolution_limits": [79.320,10.290],
"number_observations": 19658,
"number_observations_unique": 823,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 58.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 23.900
}
]
}
]
}