Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a2c178b546e1c8a7657471bf7f8821bd",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 139.973,
"b": 139.973,
"c": 73.236,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.690,2.100],
"number_observations": 323440,
"number_observations_unique": 15971,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 36.800
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 20.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.100],
"number_observations": 28112,
"number_observations_unique": 1294,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.768
},
{
"type": "R(meas)",
"value": 0.786
},
{
"type": "R(pim)",
"value": 0.168
},
{
"type": "I/SigI",
"value": 5.000
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 21.700
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
{
"resolution_limits": [46.690,8.910],
"number_observations": 3839,
"number_observations_unique": 236,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 97.000
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 16.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}