Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "44d4a7075d1fbf341de489ab4abdbf6c",
"space_group_name": "P 21 3",
"unit_cell": {
"a": 167.618,
"b": 167.618,
"c": 167.618,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.390,3.900],
"number_observations": 145035,
"number_observations_unique": 14545,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.122
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 15.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 10.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [4.360,3.900],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.062
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 10.300
},
{
"type": "CC(1/2)",
"value": 0.877
}
]
},
{
"resolution_limits": [48.390,8.730],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 9.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}