Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8d281a5310a36c544e5a12b72278d807",
"space_group_name": "P 31",
"unit_cell": {
"a": 71.130,
"b": 71.130,
"c": 56.281,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97853],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [61.600,2.100],
"number_observations": 85544,
"number_observations_unique": 18285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "R(meas)",
"value": 0.192
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 6.900
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.100],
"number_observations": 7260,
"number_observations_unique": 1542,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.938
},
{
"type": "R(meas)",
"value": 1.055
},
{
"type": "R(pim)",
"value": 0.477
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.392
}
]
},
{
"resolution_limits": [61.600,8.910],
"number_observations": 1079,
"number_observations_unique": 239,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 16.500
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
}
]
}