Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6b2c839150f1d679da7275a5dab84d37",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 92.647,
"b": 92.647,
"c": 318.545,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.803,2.700],
"number_observations_unique": 14898,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.140
},
{
"type": "R(meas)",
"value": 0.149
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.830,2.700],
"number_observations": 18675,
"number_observations_unique": 1949,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.279
},
{
"type": "R(meas)",
"value": 1.354
},
{
"type": "R(pim)",
"value": 0.438
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 0.918
}
]
},
{
"resolution_limits": [39.800,8.950],
"number_observations": 3638,
"number_observations_unique": 456,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 26.900
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 8.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}