Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d4929e133d6f77f7bda03b027cf32cf6",
"space_group_name": "P 63",
"unit_cell": {
"a": 124.375,
"b": 124.375,
"c": 91.438,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.410,3.910],
"number_observations": 123824,
"number_observations_unique": 7403,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.130
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 9.000
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 16.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [4.010,3.910],
"number_observations": 8035,
"number_observations_unique": 549,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.767
},
{
"type": "R(meas)",
"value": 10.128
},
{
"type": "R(pim)",
"value": 2.601
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 14.600
},
{
"type": "CC(1/2)",
"value": 0.148
}
]
},
{
"resolution_limits": [46.410,17.470],
"number_observations": 1148,
"number_observations_unique": 88,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 58.400
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 13.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}