Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6413d8dc1d76326de6e8ee32b5ba832c",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 67.097,
"b": 67.097,
"c": 99.432,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.600],
"number_observations_unique": 30563,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 17.400
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 14.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.660,1.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.458
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 13.500
}
]
},
{
"resolution_limits": [1.720,1.660],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.335
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.400
}
]
},
{
"resolution_limits": [1.800,1.720],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.236
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.400
}
]
},
{
"resolution_limits": [1.900,1.800],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.400
}
]
},
{
"resolution_limits": [2.020,1.900],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.400
}
]
},
{
"resolution_limits": [2.170,2.020],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.300
}
]
},
{
"resolution_limits": [2.390,2.170],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.300
}
]
},
{
"resolution_limits": [2.740,2.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.300
}
]
},
{
"resolution_limits": [3.450,2.740],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 13.700
}
]
},
{
"resolution_limits": [50.000,3.450],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "Completeness",
"value": 93.700
},
{
"type": "Redundancy",
"value": 12.000
}
]
}
]
}