Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b548338b480474494b0e858227ac5914",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 61.180,
"b": 70.873,
"c": 72.081,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.45000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.640,2.180],
"number_observations": 152267,
"number_observations_unique": 16930,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.140
},
{
"type": "R(meas)",
"value": 0.148
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 11.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 9.000
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.250,2.180],
"number_observations": 13505,
"number_observations_unique": 1433,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.118
},
{
"type": "R(meas)",
"value": 1.183
},
{
"type": "R(pim)",
"value": 0.378
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 0.713
}
]
},
{
"resolution_limits": [46.640,8.990],
"number_observations": 2306,
"number_observations_unique": 286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 28.400
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 8.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}