Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "93e03fef44ddaa7f99fd190747df5ab8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 74.433,
"b": 54.144,
"c": 77.184,
"alpha": 90.000,
"beta": 92.064,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.2,2.43],
"number_observations_unique": 23390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 23.9
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 7.4
}
]
},
"refln_shells": [
{
"resolution_limits": [2.517,2.43],
"number_observations_unique": 2280,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.704
},
{
"type": "R(meas)",
"value": 0.761
},
{
"type": "R(pim)",
"value": 0.286
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.900
}
]
}
]
}