Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9c6f93addcf1339dd9451384bceedbd6",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.379,
"b": 71.379,
"c": 196.612,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.110,2.440],
"number_observations": 514800,
"number_observations_unique": 19826,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.755
},
{
"type": "R(meas)",
"value": 0.770
},
{
"type": "R(pim)",
"value": 0.149
},
{
"type": "I/SigI",
"value": 3.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.000
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [2.540,2.440],
"number_observations": 53352,
"number_observations_unique": 2186,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.178
},
{
"type": "R(meas)",
"value": 5.288
},
{
"type": "R(pim)",
"value": 1.062
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.400
},
{
"type": "CC(1/2)",
"value": 0.295
}
]
},
{
"resolution_limits": [35.110,8.800],
"number_observations": 10465,
"number_observations_unique": 516,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.129
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 19.200
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 20.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}