Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "854a31d05687143797091bbb328d3d28",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 53.071,
"b": 53.071,
"c": 112.126,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [14.180,2.050],
"number_observations": 31794,
"number_observations_unique": 11972,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 6.600
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [2.110,2.050],
"number_observations": 2099,
"number_observations_unique": 1029,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.215
},
{
"type": "R(meas)",
"value": 0.288
},
{
"type": "R(pim)",
"value": 0.190
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.905
}
]
},
{
"resolution_limits": [14.180,8.450],
"number_observations": 361,
"number_observations_unique": 155,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.145
},
{
"type": "R(pim)",
"value": 0.088
},
{
"type": "I/SigI",
"value": 12.800
},
{
"type": "Completeness",
"value": 75.600
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.895
}
]
}
]
}