Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8fddc1c18cc28e4e358f1a91a4e00051",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 37.559,
"b": 67.645,
"c": 118.142,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.560,2.900],
"number_observations": 37251,
"number_observations_unique": 7094,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 8.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [3.070,2.900],
"number_observations": 5646,
"number_observations_unique": 1081,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.510
},
{
"type": "R(pim)",
"value": 0.242
},
{
"type": "I/SigI",
"value": 4.300
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.823
}
]
},
{
"resolution_limits": [37.560,8.690],
"number_observations": 1415,
"number_observations_unique": 309,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 13.700
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
}
]
}