Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80b43280133804801b93dcfccae1bb0d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 132.793,
"b": 90.993,
"c": 110.075,
"alpha": 90.00,
"beta": 92.68,
"gamma": 90.00
},
"wavelengths": [1.59980],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,3.200],
"number_observations_unique": 21183,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "I/SigI",
"value": 12.100
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 7.300
}
]
},
"refln_shells": [
{
"resolution_limits": [3.310,3.200],
"number_observations_unique": 2082,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.515
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 7.100
}
]
},
{
"resolution_limits": [3.450,3.310],
"number_observations_unique": 2073,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.351
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 7.200
}
]
},
{
"resolution_limits": [3.600,3.450],
"number_observations_unique": 2097,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.269
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 7.200
}
]
},
{
"resolution_limits": [3.790,3.600],
"number_observations_unique": 2090,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.221
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 7.300
}
]
},
{
"resolution_limits": [4.030,3.790],
"number_observations_unique": 2104,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 7.300
}
]
},
{
"resolution_limits": [4.340,4.030],
"number_observations_unique": 2106,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 7.400
}
]
},
{
"resolution_limits": [4.780,4.340],
"number_observations_unique": 2136,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 7.400
}
]
},
{
"resolution_limits": [5.470,4.780],
"number_observations_unique": 2118,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 7.300
}
]
},
{
"resolution_limits": [6.890,5.470],
"number_observations_unique": 2165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 7.000
}
]
},
{
"resolution_limits": [50.000,6.890],
"number_observations_unique": 2212,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 7.300
}
]
}
]
}