Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "75d59283e34b84af69e3d682b8c0dee3",
"space_group_name": "P 31",
"unit_cell": {
"a": 65.686,
"b": 65.686,
"c": 36.144,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,2.600],
"number_observations_unique": 5306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "I/SigI",
"value": 14.200
},
{
"type": "Completeness",
"value": 99.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.69,2.60],
"number_observations_unique": 1037,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.471
},
{
"type": "Completeness",
"value": 98.20
}
]
},
{
"resolution_limits": [2.80,2.69],
"number_observations_unique": 1077,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.283
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [2.93,2.80],
"number_observations_unique": 1030,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.218
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [3.08,2.93],
"number_observations_unique": 1094,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.167
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [3.28,3.08],
"number_observations_unique": 1099,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [3.53,3.28],
"number_observations_unique": 1025,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "Completeness",
"value": 98.30
}
]
},
{
"resolution_limits": [3.88,3.53],
"number_observations_unique": 1036,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "Completeness",
"value": 98.20
}
]
},
{
"resolution_limits": [4.45,3.88],
"number_observations_unique": 1070,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "Completeness",
"value": 98.70
}
]
},
{
"resolution_limits": [5.60,4.45],
"number_observations_unique": 1041,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [90.00,5.60],
"number_observations_unique": 1055,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 97.10
}
]
}
]
}