Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "830b9260f9faf3d68fff22eab1b3e4a3",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.387,
"b": 95.387,
"c": 45.881,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.720,1.340],
"number_observations": 546720,
"number_observations_unique": 46407,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(meas)",
"value": 0.121
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 12.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.360,1.340],
"number_observations": 11805,
"number_observations_unique": 2225,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.020
},
{
"type": "R(meas)",
"value": 2.242
},
{
"type": "R(pim)",
"value": 0.960
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.382
}
]
},
{
"resolution_limits": [33.720,7.340],
"number_observations": 3713,
"number_observations_unique": 307,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 73.600
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}