Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4187240bb1126f2fbd8d9a2f6d11a5d7",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.038,
"b": 71.038,
"c": 196.314,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.800,1.390],
"number_observations": 2330382,
"number_observations_unique": 102976,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(meas)",
"value": 0.118
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 16.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.460,1.390],
"number_observations": 195672,
"number_observations_unique": 14779,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.015
},
{
"type": "R(meas)",
"value": 3.136
},
{
"type": "R(pim)",
"value": 0.846
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 13.200
},
{
"type": "CC(1/2)",
"value": 0.485
}
]
},
{
"resolution_limits": [66.800,4.380],
"number_observations": 82041,
"number_observations_unique": 3644,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 66.100
},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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},
{
"type": "CC(1/2)",
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}
]
}
]
}