Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "830c90b5370360a4e2c5bccb2b812fff",
"space_group_name": "I 41 2 2",
"unit_cell": {
"a": 57.861,
"b": 57.861,
"c": 184.650,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.160,1.500],
"number_observations": 139854,
"number_observations_unique": 21730,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 11.600
},
{
"type": "Completeness",
"value": 84.500
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.500],
"number_observations": 5173,
"number_observations_unique": 953,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.705
},
{
"type": "R(meas)",
"value": 0.775
},
{
"type": "R(pim)",
"value": 0.312
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 75.300
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.807
}
]
},
{
"resolution_limits": [46.160,8.220],
"number_observations": 1437,
"number_observations_unique": 190,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 23.300
},
{
"type": "Completeness",
"value": 94.900
},
{
"type": "Redundancy",
"value": 7.600
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}