Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ddf2bcc95e9ef3c26529250715173cd8",
"space_group_name": "P 41",
"unit_cell": {
"a": 161.311,
"b": 161.311,
"c": 139.880,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.400,2.550],
"number_observations": 867930,
"number_observations_unique": 116252,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.148
},
{
"type": "R(meas)",
"value": 0.159
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 8.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.600,2.550],
"number_observations": 36367,
"number_observations_unique": 5760,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.245
},
{
"type": "R(meas)",
"value": 2.453
},
{
"type": "R(pim)",
"value": 0.976
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.169
}
]
},
{
"resolution_limits": [88.400,13.980],
"number_observations": 5243,
"number_observations_unique": 731,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 22.300
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}