Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "bb61b7661f26c419472c374a88504669",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.940,
"b": 102.401,
"c": 146.486,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03317],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.830,2.090],
"number_observations": 262229,
"number_observations_unique": 40194,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 12.700
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.140,2.090],
"number_observations": 19812,
"number_observations_unique": 2996,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.033
},
{
"type": "R(meas)",
"value": 2.207
},
{
"type": "R(pim)",
"value": 0.849
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.320
}
]
},
{
"resolution_limits": [48.830,9.090],
"number_observations": 3449,
"number_observations_unique": 585,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 43.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}